SMILES for ATR-interacting protein/Serine/threonine-protein kinase ATR

C[C@@H]1Cc2ncnc(C3CCC(CC3)NS(C)(=O)=O)c2CN1c1cc(Cl)nc2[nH]ccc12 |r,wU:1.0,(1.43,5.78,;.09,5,;-1.24,5.78,;-2.57,5,;-3.91,5.78,;-5.24,5,;-5.24,3.47,;-3.91,2.69,;-3.91,1.15,;-5.24,.38,;-5.24,-1.15,;-3.91,-1.93,;-2.57,-1.15,;-2.57,.38,;-3.91,-3.47,;-2.57,-4.23,;-2.57,-5.78,;-1.24,-3.47,;-1.24,-5,;-2.57,3.47,;-1.24,2.69,;.09,3.47,;1.43,2.69,;1.43,1.15,;2.76,.38,;2.76,-1.15,;4.1,1.15,;4.1,2.69,;5.24,3.73,;4.61,5.13,;3.08,4.97,;2.76,3.47,)|

BDBM414049

CC1CCN(C1)c1ncnc2C[C@@H](C)N(Cc12)c1cc(Cl)nc2[nH]ccc12 |r|

BDBM414050

C[C@@H]1Cc2ncnc(C3CCN(CC3)S(C)(=O)=O)c2CN1c1ccnc2[nH]ncc12 |r|

BDBM414052

CNC(=O)[C@@H]1CCCN(C1)c1ncnc2C[C@@H](C)N(Cc12)c1cc(Cl)nc2[nH]ccc12 |r|

BDBM414053

C[C@@H]1Cc2ncnc(N3CCC[C@@H](C3)C(C)(C)O)c2CN1c1cc(Cl)nc2[nH]ccc12 |r|

BDBM414054

CCC1(O)CCN(CC1)c1ncnc2C[C@@H](C)N(Cc12)c1cc(Cl)nc2[nH]ccc12 |r|

BDBM414055

C[C@@H]1Cc2ncnc(C3CN(C3)S(C)(=O)=O)c2CN1c1cc(Cl)nc2[nH]ccc12 |r|

BDBM414056

C[C@@H]1Cc2ncnc([C@H]3CCN(C(C)(C)C3)S(C)(=O)=O)c2CN1c1ccnc2[nH]ccc12 |r|

BDBM414057

C[C@@H]1Cc2ncnc([C@@H]3CCN(C(C)(C)C3)S(C)(=O)=O)c2CN1c1ccnc2[nH]ccc12 |r|

BDBM414058

C[C@@H]1Cc2ncnc(C3CCN(CC3)C(=O)C(C)(C)O)c2CN1c1ccnc2[nH]ccc12 |r|

BDBM414059

C[C@@H]1Cc2ncnc([C@@H]3CCCN(C3)S(C)(=O)=O)c2CN1c1ccnc2[nH]ccc12 |r|

BDBM414060

C[C@@H]1Cc2ncnc([C@H]3CCCN(C3)S(C)(=O)=O)c2CN1c1ccnc2[nH]ccc12 |r|

BDBM414061

C[C@@H]1Cc2ncnc([C@@H]3CCCN(C)C3)c2CN1c1cc(Cl)nc2[nH]ccc12 |r|

BDBM414062

C[C@@H]1Cc2ncnc([C@H]3CCCN(C)C3)c2CN1c1cc(Cl)nc2[nH]ccc12 |r|

BDBM414063

CS(=O)(=O)N1CCC(CC1)c1ncnc2C[C@@H](CF)N(Cc12)c1ccnc2[nH]ccc12 |r|

BDBM414064

CS(=O)(=O)N1CCC(CC1)c1ncnc2C[C@H](CF)N(Cc12)c1ccnc2[nH]ccc12 |r|

BDBM414065

CS(=O)(=O)N1CCC(CC1)c1ncnc2C[C@H](C(F)F)N(Cc12)c1ccnc2[nH]ccc12 |r|

BDBM414066

CCOc1cc(N2Cc3c(C[C@H]2C)ncnc3C2CCN(CC2)S(C)(=O)=O)c2cc[nH]c2n1 |r|

BDBM414067

CCOc1cc(N2Cc3c(C[C@H]2CF)ncnc3C2CCN(CC2)S(C)(=O)=O)c2cc[nH]c2n1 |r|

BDBM414068

CCOc1cc(N2Cc3c(C[C@@H]2CF)ncnc3C2CCN(CC2)S(C)(=O)=O)c2cc[nH]c2n1 |r|

BDBM414069

C[C@@H]1Cc2ncnc(C3CCN(CC3)S(C)(=O)=O)c2CN1c1cc(C)nc2[nH]ccc12 |r|

BDBM414070

C[C@@H]1Cc2ncnc([C@H]3CCN(C)C3)c2CN1c1ccnc2[nH]ccc12 |r|

BDBM414071

C[C@@H]1Cc2ncnc([C@@H]3CCN(C)C3)c2CN1c1ccnc2[nH]ccc12 |r|

BDBM414072

C[C@@H]1Cc2ncnc(N3CCC(CC3)S(C)(=N)=O)c2CN1c1cc(Cl)nc2[nH]ccc12 |r|

BDBM414073

C[C@@H]1Cc2ncnc(C3CCN(CC3)S(C)(=O)=O)c2CN1c1nccc2[nH]ccc12 |r|

BDBM414074

C[C@@H]1Cc2ncnc(C3=CC4CCC(C3)N4S(C)(=O)=O)c2CN1c1cc(Cl)nc2[nH]ccc12 |r,t:8|

BDBM414075

C[C@@H]1Cc2ncnc(N3CCC4(CC3)NC(=O)NC4=O)c2CN1c1cc(Cl)nc2[nH]ccc12 |r|

BDBM414076

COC(=O)[C@@H]1CCCN(C1)c1ncnc2C[C@@H](C)N(Cc12)c1cc(Cl)nc2[nH]ccc12 |r|

BDBM414077

COC(=O)[C@H]1CCCN(C1)c1ncnc2C[C@@H](C)N(Cc12)c1cc(Cl)nc2[nH]ccc12 |r|

BDBM414078

C[C@@H]1Cc2ncnc(N3CCC(CC3)NS(C)(=O)=O)c2CN1c1ccnc2[nH]ccc12 |r|

BDBM414079

C[C@@H]1Cc2ncnc(N3CCCC(C3)S(C)(=O)=O)c2CN1c1cc(Cl)nc2[nH]ccc12 |r|

BDBM414080

C[C@@H]1Cc2ncnc(N3CCC(C)(O)CC3)c2CN1c1cc(Cl)nc2[nH]ccc12 |r|

BDBM414081

CNC(=O)[C@H]1CCCN(C1)c1ncnc2C[C@@H](C)N(Cc12)c1cc(Cl)nc2[nH]ccc12 |r|

BDBM414082

COC1CCN(CC1)c1ncnc2C[C@@H](C)N(Cc12)c1cc(Cl)nc2[nH]ccc12 |r|

BDBM414083

C[C@@H]1Cc2ncnc(N3CC4CCC(C3)C4NS(C)(=O)=O)c2CN1c1cc(Cl)nc2[nH]ccc12 |r|

BDBM414084

C[C@@H]1Cc2ncnc(N3CCC[C@H](C3)C(C)(C)O)c2CN1c1cc(Cl)nc2[nH]ccc12 |r|

BDBM414085

C[C@@H]1Cc2ncnc(N3CCC[C@@H](C3)NS(C)(=O)=O)c2CN1c1cc(Cl)nc2[nH]ccc12 |r|

BDBM414086

C[C@@H]1Cc2ncnc(N3CCC[C@H](C3)NS(C)(=O)=O)c2CN1c1cc(Cl)nc2[nH]ccc12 |r|

BDBM414087

C[C@@H]1Cc2ncnc(C3=CCC(CC3)NS(C)(=O)=O)c2CN1c1cc(Cl)nc2[nH]ccc12 |r,t:8|

BDBM414088

C[C@@H]1Cc2ncnc(C3C[C@@H]4CC[C@H](C3)[C@@H]4NS(C)(=O)=O)c2CN1c1ccnc2[nH]ccc12 |r|

BDBM414089

C[C@@H]1Cc2ncnc(N3CCC(O)(CC3)C3CC3)c2CN1c1cc(Cl)nc2[nH]ccc12 |r|

BDBM414090

CNC(=O)C1CCN(CC1)c1ncnc2C[C@@H](C)N(Cc12)c1cc(Cl)nc2[nH]ccc12 |r|

BDBM414091

C[C@@H]1Cc2ncnc(N3CC(O)C3)c2CN1c1cc(Cl)nc2[nH]ccc12 |r|

BDBM414092

C[C@@H]1Cc2ncnc(N3C[C@@H]4CC[C@H](C3)[C@@H]4NS(=O)(=O)C3CC3)c2CN1c1cc(Cl)nc2[nH]ccc12 |r|

BDBM414093

C[C@@H]1Cc2ncnc(N3CC(C3)C#N)c2CN1c1cc(Cl)nc2[nH]ccc12 |r|

BDBM414094

C[C@@H]1Cc2ncnc(C3CCN(CC3)S(=O)(=O)C3CC3)c2CN1c1ccnc2[nH]ccc12 |r|

BDBM414095

C[C@@H]1Cc2ncnc(N3CC(C3)C#N)c2CN1c1ccnc2[nH]ccc12 |r|

BDBM414096

C[C@@H]1Cc2ncnc(N3CCC(CC3)C#N)c2CN1c1ccnc2[nH]ccc12 |r|

BDBM414097

C[C@@H]1Cc2ncnc(N3CCCC(C3)C#N)c2CN1c1ccnc2[nH]ccc12 |r|

BDBM414098

C[C@@H]1Cc2ncnc(N3CC(C3)NS(C)(=O)=O)c2CN1c1ccnc2[nH]ccc12 |r|

BDBM414099

C[C@@H]1Cc2ncnc(N3CC(C3)NS(=O)(=O)C3CC3)c2CN1c1ccnc2[nH]ccc12 |r|

BDBM414100

C[C@@H]1Cc2ncnc(N3CC[C@@H](C3)S(C)(=O)=O)c2CN1c1cc(Cl)nc2[nH]ccc12 |r|

BDBM414101

C[C@@H]1Cc2ncnc(N3CC[C@H](C3)S(C)(=O)=O)c2CN1c1cc(Cl)nc2[nH]ccc12 |r|

BDBM414103

C[C@@H]1Cc2ncnc(C3CCN(CC3)S(C)(=O)=O)c2CN1c1cnc2cn[nH]c2c1 |r|

BDBM414104

COc1cc(N2Cc3c(C[C@H]2C)ncnc3C2CCN(CC2)S(C)(=O)=O)c2cc[nH]c2n1 |r|

BDBM414105

CS(=O)(=O)N1CCC(CC1)c1ncnc2CC(CF)N(Cc12)c1ccnc2[nH]ccc12

BDBM414106

CC(C)Oc1cc(N2Cc3c(C[C@H]2C)ncnc3C2CCN(CC2)S(C)(=O)=O)c2cc[nH]c2n1 |r|

BDBM414107

C[C@@H]1Cc2ncnc(C3CCN(CC3)S(C)(=O)=O)c2CN1c1ccnc2[nH]c(C)cc12 |r|

BDBM414108

C[C@@H]1Cc2ncnc(C3CCN(CC3)S(C)(=O)=O)c2CN1c1cc(nc2[nH]ccc12)C1CC1 |r|

BDBM414109

C[C@@H]1Cc2ncnc(C3CCN(CC3)S(C)(=O)=O)c2CN1c1cc(OCC(F)(F)F)nc2[nH]ccc12 |r|

BDBM414110

C[C@@H]1Cc2ncnc(C3CCN(CC3)S(C)(=O)=O)c2CN1c1cc(OC2CC2)nc2[nH]ccc12 |r|

BDBM414111

C[C@@H]1Cc2ncnc(C3CCN(CC3)S(C)(=O)=O)c2CN1c1cc(nc2[nH]ccc12)C#N |r|

BDBM414112

C[C@@H]1Cc2ncnc(C3CCN(CC3)S(C)(=O)=O)c2CN1c1cc(OC2CCC2)nc2[nH]ccc12 |r|

BDBM458742

CC1Cc2ncnc(-c3ccc(cc3)S(C)(=O)=O)c2CN1c1cccc2[nH]ccc12

BDBM458749

C[C@@H]1Cc2ncnc(C3C[C@H]4CC[C@H](C3)N4S(C)(=O)=O)c2CN1c1cc(Cl)nc2[nH]ccc12 |r|

BDBM458750

C[C@@H]1Cc2ncnc(C3C[C@@H]4CC[C@H](C3)N4S(C)(=O)=O)c2CN1c1cc(Cl)nc2[nH]ccc12 |r,THB:16:15:8.9.14:11.12|

BDBM458785

C[C@@H]1Cc2ncnc(C3CCN(C(C)(C)C3)S(C)(=O)=O)c2CN1c1ccnc2[nH]ccc12 |r|

BDBM458786

C[C@H]1Cc2ncnc(C3CCN(C(C)(C)C3)S(C)(=O)=O)c2CN1c1ccnc2[nH]ccc12 |r|

BDBM458790

C[C@H]1Cc2ncnc(C3CCCN(C3)S(C)(=O)=O)c2CN1c1ccnc2[nH]ccc12 |r|

BDBM458791

C[C@@H]1Cc2ncnc(C3CCCN(C)C3)c2CN1c1cc(Cl)nc2[nH]ccc12 |r|

BDBM458792

C[C@H]1Cc2ncnc(C3CCCN(C)C3)c2CN1c1cc(Cl)nc2[nH]ccc12 |r|

BDBM458795

CS(=O)(=O)N1CCC(CC1)c1ncnc2C[C@@H](C(F)F)N(Cc12)c1ccnc2[nH]ccc12 |r|

BDBM458800

C[C@@H]1Cc2ncnc(C3CCN(C)C3)c2CN1c1ccnc2[nH]ccc12 |r|

BDBM458801

C[C@H]1Cc2ncnc(C3CCN(C)C3)c2CN1c1ccnc2[nH]ccc12 |r|

BDBM458814

C[C@@H]1Cc2ncnc(N3CC4CCC(C3)C4NS(C)(=O)=O)c2CN1c1ccnc2[nH]ccc12 |r|

BDBM458819

C[C@@H]1Cc2ncnc(N3C[C@@H]4CC[C@H](C3)[C@@H]4NS(C)(=O)=O)c2CN1c1ccnc2[nH]ccc12 |r|

BDBM459492

CCOC(=O)N=S(C)(=O)c1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM267970

CS(=N)(=O)c1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM459494

CS(=O)(=O)c1ccc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM459495

C1CN(CCO1)c1cc(C2=CCOCC2)c2ccnc(-c3cc[nH]n3)c2n1 |t:10|

BDBM459496

CN=S(C)(=O)c1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM459497

Cc1cc(ncc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1)S(C)(=O)=O

BDBM459498

CS(=O)(=O)c1ccc(cc1)-c1cc(nc2c(nccc12)-c1cc[nH]n1)N1CCOCC1

BDBM459499

CS(=O)(=O)c1ccccc1-c1cc(nc2c(nccc12)-c1cc[nH]n1)N1CCOCC1

BDBM459500

COP(=O)(OC)c1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM459501

CC(=C)c1cc(nc2c(nccc12)-c1cc[nH]n1)N1CCOCC1

BDBM459502

C1CN(CCO1)c1cc(-c2ccccc2)c2ccnc(-c3cc[nH]n3)c2n1

BDBM459503

CCS(=N)(=O)c1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM459504

CCOC(=O)N=S(C)(=O)c1cccc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM459505

CN1CCC(=CC1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1 |c:4|

BDBM459506

CS(=O)(=O)c1cccc(c1)-c1cc(nc2c(nccc12)-c1cc[nH]n1)N1CCOCC1

BDBM459507

Cc1cc(cnc1S(C)(=O)=O)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM459508

C1CC(=CCN1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1 |c:2|

BDBM459509

C1CC1c1cc(nc2c(nccc12)-c1cc[nH]n1)N1CCOCC1

BDBM267987

CS(=N)(=O)c1cccc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM459511

Cc1cc(nc2c(nccc12)-c1cc[nH]n1)N1CCOCC1

BDBM459512

CS(=O)(=O)c1nc(cs1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM459513

O=c1cc(cc[nH]1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM459514

O=c1ccc(c[nH]1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM459515

CS(=O)(=O)c1ccc(c(F)c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM459516

CC(C)S(=N)(=O)c1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM459517

C[C@@H]1COCCN1c1cc(-c2ccc(cc2)S(C)(=O)=O)c2ccnc(-c3cc[nH]n3)c2n1 |r|

BDBM459518

C[C@@H]1COCCN1c1cc(-c2ccccc2)c2ccnc(-c3cc[nH]n3)c2n1 |r|

BDBM459519

C[C@@H]1COCCN1c1cc(-c2cccc(c2)S(C)(=O)=O)c2ccnc(-c3cc[nH]n3)c2n1 |r|

BDBM459520

C[C@@H]1COCCN1c1cc(C2CC2)c2ccnc(-c3cc[nH]n3)c2n1 |r|

BDBM459521

C[C@@H]1COCCN1c1cc(-c2ccc(cc2)S(C)(=N)=O)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459522

C[C@@H]1COCCN1c1cc(-c2cccc(c2)S(C)(=N)=O)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459523

CS(=O)(=O)c1cc(nc2c(nccc12)-c1cc[nH]n1)N1CCOCC1

BDBM459524

C[C@@H]1COCCN1c1cc(c2ccnc(-c3ccn[nH]3)c2n1)S(C)(=O)=O |r|

BDBM459525

N#Cc1cc(nc2c(nccc12)-c1cc[nH]n1)N1CCOCC1

BDBM459526

C[C@@H]1COCCN1c1cc(C#N)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459527

NC(=O)c1cc(nc2c(nccc12)-c1cc[nH]n1)N1CCOCC1

BDBM459528

CS(=O)(=O)Cc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268006

OCc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM459530

CS(=O)(=O)C1(CC1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM459531

CC(C)Oc1cc(nc2c(nccc12)-c1cc[nH]n1)N1CCOCC1

BDBM459532

CC(C)Oc1cc(nc2c(nccc12)-c1ccc[nH]1)N1CCOCC1

BDBM459533

CS(=N)(=O)CCCOc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM459534

CCOc1cc(nc2c(nccc12)-c1cc[nH]n1)N1CCOCC1

BDBM459535

COc1cc(nc2c(nccc12)-c1cc[nH]n1)N1CCOCC1

BDBM459536

CC(C)(O)COc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268014

C(Oc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1)C1CCCO1

BDBM268015

O=C1OCCC1Oc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268016

Cc1cc(COc2cc(nc3c(nccc23)-c2ccn[nH]2)N2CCOCC2)on1

BDBM268017

Cc1cc(COc2cc(nc3c(nccc23)-c2ccn[nH]2)N2CCOCC2)no1

BDBM459541

C(Oc1cc(nc2c(nccc12)-c1cc[nH]n1)N1CCOCC1)c1ccccc1

BDBM459542

CC(C)Oc1cc(nc2c(nccc12)-c1cc[nH]n1)N1CCOC[C@H]1C |r|

BDBM459543

C[C@@H]1COCCN1c1cc(OCCCCNC(=O)OC(C)(C)C)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459544

COc1cc(nc2c(nccc12)-c1cc[nH]n1)N1CCOC[C@H]1C |r|

BDBM459545

C[C@@H]1COCCN1c1cc(OCCCNC(=O)OC(C)(C)C)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268023

C[C@@H]1COCCN1c1cc(OCCN)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459547

C[C@@H]1COCCN1c1cc(OCCNC(=O)OC(C)(C)C)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268025

C[C@@H]1COCCN1c1cc(OCCCCN)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268026

CC(C)Oc1cc(nc2c(nccc12)-c1ccn[nH]1)N1[C@@H](C)COC[C@H]1C |r|

BDBM268027

CC(C)Oc1cc(nc2c(nccc12)-c1ccn[nH]1)N1[C@H](C)COC[C@H]1C |r|

BDBM459551

C1CC(CCO1)c1cc(nc2c(nccc12)-c1cc[nH]n1)N1CCOCC1

BDBM459552

C1CN(CCO1)c1ccc2ccnc(-c3cc[nH]n3)c2n1

BDBM459553

Clc1cc(nc2c(nccc12)-c1cc[nH]n1)N1CCOCC1

BDBM459554

CSc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|

BDBM459555

C[C@@H]1COCCN1c1cc(N=S2(=O)CCOCC2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459556

CS(C)(=O)=Nc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM459557

C[C@@H]1COCCN1c1cc(N2CCNCC2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459558

CC(C)Oc1cc(nc2c(nccc12)-c1cc[nH]n1)N1CCOC[C@@H]1C |r|

BDBM268036

CC(C)Oc1cc(nc2c(nccc12)-c1cc[nH]c1)N1CCOCC1

BDBM459560

CCn1nccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|

BDBM459561

C[C@@H]1COCCN1c1cc(-c2cncn2C)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459562

C[C@@H]1COCCN1c1cc(-c2ccccc2N)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459563

C[C@@H]1COCCN1c1cc(-c2cccc(F)c2F)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459564

C[C@@H]1COCCN1c1cc(-c2ccc(nc2C)S(C)(=O)=O)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459565

C[C@@H]1COCCN1c1cc(-c2ccc(cc2F)S(C)(=O)=O)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459566

C[C@@H]1COCCN1c1cc(-c2cc(F)ccc2N)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459567

C[C@@H]1COCCN1c1cc(-c2cncn2Cc2ccccc2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459568

C[C@@H]1COCCN1c1cc(-c2ccccc2F)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459569

C[C@@H]1COCCN1c1cc(-c2cnc(C)s2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459570

C[C@@H]1COCCN1c1cc(-c2cnc(cc2C)S(C)(=O)=O)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459571

C[C@@H]1COCCN1c1cc(-c2ccnn2C2CC2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459572

C[C@@H]1COCCN1c1cc(-c2ccc(cc2F)N2CCNCC2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459573

C[C@@H]1COCCN1c1cc(N2CCN(CC2)S(C)(=O)=O)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459574

C[C@@H]1COCCN1c1cc(N(C)CC(C)(C)C)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459575

C[C@@H]1COCCN1c1cc(N2CCC(CO)CC2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459576

C[C@@H]1COCCN1c1cc(N(C)C2CC2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459577

C[C@@H]1COCCN1c1cc(N2CCn3ccnc3C2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459578

C[C@@H]1COCCN1c1cc(N(C)c2ccc(F)cc2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268056

C[C@@H]1COCCN1c1cc(-c2ccc(C)nc2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268057

C[C@@H]1COCCN1c1cc(-c2cccnc2F)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268058

C[C@@H]1COCCN1c1cc(-c2c(C)ccnc2F)c2ccnc(-c3ccn[nH]3)c2n1 |r,wU:1.0,(-.67,4.21,;-2,3.44,;-3.33,4.21,;-4.67,3.44,;-4.67,1.9,;-3.33,1.13,;-2,1.9,;-.67,1.13,;-.67,-.41,;.67,-1.18,;.67,-2.72,;-.67,-3.49,;-2,-2.72,;-.67,-5.03,;.67,-5.8,;2,-5.03,;2,-3.49,;3.33,-2.72,;2,-.41,;3.33,-1.18,;4.67,-.41,;4.67,1.13,;3.33,1.9,;3.33,3.44,;2.09,4.34,;2.56,5.8,;4.1,5.8,;4.58,4.34,;2,1.13,;.67,1.9,)|

BDBM268059

C[C@@H]1COCCN1c1cc(-c2cccn2C)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268060

C[C@@H]1COCCN1c1cc(-c2cnc(F)c(C)c2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268061

C[C@@H]1COCCN1c1cc(-c2ccc(C)nc2F)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268062

C[C@@H]1COCCN1c1cc(-c2ccc(F)nc2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268063

COc1ccc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|

BDBM268064

COc1ncc(cc1C)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|

BDBM268065

C[C@@H]1COCCN1c1cc(-c2ccc(F)nc2C)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268066

C[C@@H]1COCCN1c1cc(-c2cc(nn2C)C(F)(F)F)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268067

C[C@@H]1COCCN1c1cc(-c2sccc2C)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268068

C[C@@H]1COCCN1c1cc(-c2ccc(C)s2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268069

C[C@@H]1COCCN1c1cc(-c2cscc2C)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268070

C[C@@H]1COCCN1c1cc(-c2sccc2Cl)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268071

C[C@@H]1COCCN1c1cc(-c2ccsc2C)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268072

C[C@@H]1COCCN1c1cc(-c2ccnc3[nH]ccc23)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268073

C[C@@H]1COCCN1c1cc(-c2c(C)noc2C)c2ccnc(-c3ccn[nH]3)c2n1 |r,wU:1.0,(-.67,3.85,;-2,3.08,;-3.33,3.85,;-4.67,3.08,;-4.67,1.54,;-3.33,.77,;-2,1.54,;-.67,.77,;-.67,-.77,;.67,-1.54,;.67,-3.08,;-.58,-3.99,;-1.91,-3.22,;-.1,-5.45,;1.44,-5.45,;1.91,-3.99,;3.25,-3.22,;2,-.77,;3.33,-1.54,;4.67,-.77,;4.67,.77,;3.33,1.54,;3.33,3.08,;2.09,3.99,;2.56,5.45,;4.1,5.45,;4.58,3.99,;2,.77,;.67,1.54,)|

BDBM268074

COc1nccc(c1Cl)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|

BDBM268075

C[C@@H]1COCCN1c1cc(C2CCOCC2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268076

C[C@@H]1COCCN1c1cc(C2=CCSCC2)c2ccnc(-c3ccn[nH]3)c2n1 |r,t:11|

BDBM268077

CC1CCN(CC1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|

BDBM268078

C[C@@H]1COCCN1c1cc(-c2ccnn2C(C)(C)C)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268079

C[C@@H]1COCCN1c1cc(-c2ccnn2C)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459603

C[C@@H]1COCCN1c1cc(-c2cc(C)no2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459604

CCn1nc(C)cc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|

BDBM459605

C[C@@H]1COCCN1c1cc(-c2c(C)cnn2C)c2ccnc(-c3ccn[nH]3)c2n1 |r,wU:1.0,(-.67,3.85,;-2,3.08,;-3.33,3.85,;-4.67,3.08,;-4.67,1.54,;-3.33,.77,;-2,1.54,;-.67,.77,;-.67,-.77,;.67,-1.54,;.67,-3.08,;1.91,-3.99,;3.4,-3.59,;1.44,-5.45,;-.1,-5.45,;-.58,-3.99,;-2.07,-3.59,;2,-.77,;3.33,-1.54,;4.67,-.77,;4.67,.77,;3.33,1.54,;3.33,3.08,;2.09,3.99,;2.56,5.45,;4.1,5.45,;4.58,3.99,;2,.77,;.67,1.54,)|

BDBM459606

CSc1ccc(c(C)n1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|

BDBM459607

C[C@@H]1COCCN1c1cc(-c2ccc(nc2C)S(C)(=N)=O)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459608

CCCn1nccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|

BDBM459609

C[C@@H]1COCCN1c1cc(-c2cnc3CCCn23)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459610

CCn1nc(cc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C)C(F)(F)F |r|

BDBM459611

COC(=O)c1ccc([nH]1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|

BDBM459612

C[C@@H]1COCCN1c1cc(-c2ccns2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459613

C[C@@H]1COCCN1c1cc(-c2ccccc2N(C)C)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459614

C[C@@H]1COCCN1c1cc(-c2ccc(F)cc2F)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459615

CC(C)n1nccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|

BDBM459616

CCOP(C)(=O)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|

BDBM459617

CCS(=O)(CC)=Nc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|

BDBM459618

CC(C)COP(C)(=O)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|

BDBM459619

C[C@@H]1COCCN1c1cc(c2ccnc(-c3ccn[nH]3)c2n1)C(C)(C)O |r|

BDBM459620

CCC(O)(CC)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|

BDBM459621

C[C@@H]1COCCN1c1cc(-c2cncc(Cl)c2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459622

C[C@@H]1COCCN1c1cc(-c2ccc(F)cc2N)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459623

C[C@@H]1COCCN1c1cc(-c2cccc(c2F)S(C)(=O)=O)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459624

C[C@@H]1COCCN1c1cc(-c2ccnn2C2COC2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459625

C[C@@H]1COCCN1c1cc(-c2ccc(cc2F)N2CCCC2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459626

COCc1noc(C)c1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r,wU:29.34,(5.32,-4.28,;3.83,-4.68,;2.75,-3.59,;1.26,-3.99,;.78,-5.45,;-.76,-5.45,;-1.23,-3.99,;-2.72,-3.59,;.01,-3.08,;.01,-1.54,;-1.32,-.77,;-1.32,.77,;.01,1.54,;1.35,.77,;2.68,1.54,;4.01,.77,;4.01,-.77,;2.68,-1.54,;1.35,-.77,;2.68,3.08,;1.43,3.99,;1.91,5.45,;3.45,5.45,;3.93,3.99,;-2.65,1.54,;-3.99,.77,;-5.32,1.54,;-5.32,3.08,;-3.99,3.85,;-2.65,3.08,;-1.32,3.85,)|

BDBM459627

C[C@@H]1COCCN1c1cc(-c2nnc(C)o2)c2ccnc(-c3ccnn3C3CCCCO3)c2n1 |r|

BDBM459628

C[C@@H]1COCCN1c1cc(N=S2(=O)CCCC2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459629

C[C@@H]1COCCN1c1cc(N=S(C)(=O)c2ccc(F)cc2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268108

C[C@@H]1COCCN1c1cc(N=S(C)(=O)c2ccccc2F)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459631

C[C@@H]1COCCN1c1cc(N=[S@](C)(=O)c2ccccc2F)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459632

C[C@@H]1COCCN1c1cc(N=[S@@](C)(=O)c2ccccc2F)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459633

C[C@@H]1COCCN1c1cc(c2ccnc(-c3ccn[nH]3)c2n1)P(C)(C)=O |r|

BDBM459634

CCP(=O)(CC)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|

BDBM459635

CCOP(=O)(CC(C)C)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|

BDBM459636

C[C@@H]1COCCN1c1cc(N2CCOCC2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459637

CC(C)Cn1nccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|

BDBM459638

C[C@@H]1COCCN1c1cc(-c2cnc(c(F)c2)S(C)(=O)=O)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459639

C[C@@H]1COCCN1c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1 |r|

BDBM459640

C[C@@H]1COCCN1c1cc(-c2[nH]ncc2C)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459641

C[C@@H]1COCCN1c1cc(-c2cc(ccc2F)S(C)(=O)=O)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268119

CC(C)S(=O)(=O)c1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|

BDBM459643

C[C@@H]1COCCN1c1cc(-c2cccc(F)n2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459644

CCn1cnc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|

BDBM459645

C[C@@H]1COCCN1c1cc(N2CCCC2C(N)=O)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459646

C[C@@H]1COCCN1c1cc(-c2cccnc2N)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459647

C[C@@H]1COCCN1c1cc(-c2ccnn2CC(F)(F)F)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459648

C[C@@H]1COCCN1c1cc(N2CCN(C)C(=O)C2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268126

C[C@@H]1COCCN1c1cc(-c2ccn(CCF)n2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268127

C[C@@H]1COCCN1c1cc(-c2ccnn2CCF)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459651

C[C@@H]1COCCN1c1cc(-c2ccn(CCO)n2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459652

C[C@@H]1COCCN1c1cc(-c2ccn(CC(C)(C)O)n2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459653

C[C@@H]1CN(CCO1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1 |r|

BDBM459654

C[C@@H]1COCCN1c1cc(-c2ccc(F)cn2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459655

C[C@@H]1COCCN1c1cc(-c2cccc(C)n2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459656

C[C@@H]1COCCN1c1cc(-c2ncccc2C)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459657

C[C@@H]1COCCN1c1cc(-c2ccccc2NC(C)=O)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459658

C[C@@H]1COCCN1c1cc(-c2cccnc2O)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459659

C[C@@H]1COCCN1c1cc(-c2cccc(c2)C(C)(C)O)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459660

C1CN(CCO1)c1cc(N2CCn3ccnc3C2)c2ccnc(-c3ccn[nH]3)c2n1

BDBM459661

C[C@H]1CN(CCO1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1 |r|

BDBM459662

C[C@H]1C[C@@H]1c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|

BDBM459663

C[C@@H]1COCCN1c1cc(OC(F)F)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459664

CC(C)(O)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM459665

C1CC2COCC1N2c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM459666

C[C@@H]1COCCN1c1cc(N2CCCC2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459667

O=C1CN(CCN1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM459668

CP(C)(=O)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM459669

C[C@H]1CN([C@H](C)CN1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1 |r|

BDBM459670

C[C@H]1CN(C[C@@H](C)N1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1 |r|

BDBM459671

OC1(CN(C1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1)C(F)(F)F

BDBM268149

COP(O)(=O)c1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM459673

CN1CCN(CC1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM459674

C1OC[C@@H]2CN(C[C@H]12)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1 |r|

BDBM459675

COC1(C)CN(C1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM459676

C1OC2C[C@@H]1N(C2)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1 |r|

BDBM459677

CSCc1cc(nc2c(nccc12)-c1ccnn1COCC[Si](C)(C)C)N1CCOC[C@H]1C |r|

BDBM268155

CN(C)c1ccc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268156

Cc1cc(ccn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM459680

C[C@@H]1COCCN1c1cc(c2ccnc(-c3ccn[nH]3)c2n1)C1(O)CCCCC1 |r|

BDBM459681

C[C@@H]1COCCN1c1cc(-c2cccc(F)c2N)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459682

CS(=O)(=NC#N)c1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM459683

CCNC(=O)N=S(C)(=O)c1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268161

C[C@@H]1COCCN1c1cc(OCCCN)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459685

C[C@@H]1COCCN1c1cc(-c2[nH]nnc2C2CC2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268163

CCS(=O)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268164

CC(C)S(=O)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268165

C[C@@H]1COCCN1c1cc(OCCCS(C)(=O)=O)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268166

O=S(=O)(c1ccccc1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268167

CC(C)S(=O)(=O)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268168

CCS(=O)(=O)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268169

O=S(c1ccccc1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268170

CS(=O)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268171

C[C@@H]1COCCN1c1cc(C2CCS(=O)CC2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268172

C[C@@H]1COCCN1c1cc(C2CCS(=O)(=O)CC2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268173

C[C@@H]1COCCN1c1cc(-c2ccn[nH]2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268174

CN(C)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268175

C1CN(CCO1)c1cc(Sc2ccccc2)c2ccnc(-c3ccn[nH]3)c2n1

BDBM268176

CC(C)Nc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268177

CCSc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268178

CC(C)Sc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268179

C1CN(CCO1)c1cc(-c2ccc[nH]2)c2ccnc(-c3ccn[nH]3)c2n1

BDBM268180

C1CN(CCO1)c1cc(-c2cc[nH]c2)c2ccnc(-c3ccn[nH]3)c2n1

BDBM268181

COc1ccc(Sc2cc(nc3c(nccc23)-c2ccn[nH]2)N2CCOCC2)cc1

BDBM268182

Cc1cc(n[nH]1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268183

O=C1CCCN1c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268184

O=S1(=O)CCCN1c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268185

O=C1CCCCN1c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268186

C[C@@H]1COCCN1c1cc(-c2cccnc2C)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268187

CC(C)Oc1ncccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|

BDBM268188

COc1ncccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|

BDBM268189

C1CN(CCO1)c1cc(-c2ccncc2)c2ccnc(-c3ccn[nH]3)c2n1

BDBM268190

COc1ccc(Sc2cc(nc3c(nccc23)-c2ccn[nH]2)N2CCOC[C@H]2C)cc1 |r|

BDBM268191

C[C@@H]1COCCN1c1cc(-c2ccnc(N3CCOCC3)c2F)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268192

Cc1cc(cnc1F)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268193

O=C1OCCCN1c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM459718

COc1cnccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|

BDBM268196

C[C@@H]1COCCN1c1cc(-c2ccc(F)nc2F)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268197

C[C@@H]1COCCN1c1cc(-c2cc(Cl)cnc2F)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268198

C[C@@H]1COCCN1c1cc(-c2ccncc2F)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268199

C[C@@H]1COCCN1c1cc(-c2cnc(C)c(C)c2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268200

C[C@@H]1COCCN1c1cc(-c2cnc(C)c(F)c2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268201

C[C@@H]1COCCN1c1cc(-c2csc(C)c2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268202

COc1ccsc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|

BDBM268203

C[C@@H]1COCCN1c1cc(-c2ccsc2Cl)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268204

C[C@@H]1COCCN1c1cc(-c2cncc3ccccc23)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268205

C[C@@H]1COCCN1c1cc(-c2ccc(Cl)s2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268206

C[C@@H]1COCCN1c1cc(-c2cc(C)cs2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268207

C[C@@H]1COCCN1c1cc(-c2cc(C)sc2C)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268208

C[C@@H]1COCCN1c1cc(C2CCSCC2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268209

C[C@@H]1COCCN1c1cc(C2=CCCN(C)C2)c2ccnc(-c3ccn[nH]3)c2n1 |r,t:11|

BDBM268210

C[C@@H]1COCCN1c1cc(C2=CCN(C)CC2)c2ccnc(-c3ccn[nH]3)c2n1 |r,t:11|

BDBM268211

C[C@@H]1COCCN1c1cc(C2CCCN(C)C2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268212

C[C@@H]1COCCN1c1cc(C2=CCNCC2)c2ccnc(-c3ccn[nH]3)c2n1 |r,t:11|

BDBM268213

C[C@@H]1COCCN1c1cc(-c2ccn(n2)C2CCOCC2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268214

C[C@@H]1COCCN1c1cc(-c2cnc(F)cc2F)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268215

C[C@@H]1COCCN1c1cc(-c2cnn(C)c2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268216

C[C@@H]1COCCN1c1cc(-c2cn(C)nc2C)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268217

C[C@@H]1COCCN1c1cc(-c2cnn(C)c2C)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268218

C[C@@H]1COCCN1c1cc(C2CCNCC2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268219

C[C@@H]1COCCN1c1cc(-c2c[nH]nc2C(F)(F)F)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268220

C[C@@H]1COCCN1c1cc(-c2cnn(c2)C2CCC2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268221

C[C@@H]1COCCN1c1cc(-c2cnn(c2)C2CC2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268222

CC(C)n1cc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|

BDBM268223

C[C@@H]1COCCN1c1cc(-c2cnn(c2)C(F)F)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268224

C[C@@H]1COCCN1c1cc(-c2cnn(c2)C(C)(C)C)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268225

C[C@@H]1COCCN1c1cc(-c2c(C)nn(C)c2C)c2ccnc(-c3ccn[nH]3)c2n1 |r,wU:1.0,(-.67,4.52,;-2,3.75,;-3.33,4.52,;-4.67,3.75,;-4.67,2.21,;-3.33,1.44,;-2,2.21,;-.67,1.44,;-.67,-.1,;.67,-.87,;.67,-2.41,;-.58,-3.32,;-1.91,-2.55,;-.1,-4.78,;1.44,-4.78,;2.21,-6.12,;1.91,-3.32,;3.25,-2.55,;2,-.1,;3.33,-.87,;4.67,-.1,;4.67,1.44,;3.33,2.21,;3.33,3.75,;2.09,4.65,;2.56,6.12,;4.1,6.12,;4.58,4.65,;2,1.44,;.67,2.21,)|

BDBM268226

C[C@@H]1COCCN1c1cc(-c2cn(C)nc2C(F)(F)F)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268227

C[C@@H]1COCCN1c1cc(-c2cnn(CCO)c2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268228

CCn1cc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|

BDBM268229

C[C@@H]1COCCN1c1cc(-c2ccn(C)c2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268230

CC(C)n1ccc(n1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|

BDBM268231

C[C@@H]1COCCN1c1cc(-c2cc(C)n(C)c2C)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268232

C[C@@H]1COCCN1c1cc(-c2cnn(c2)-c2ccccc2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268233

C[C@@H]1COCCN1c1cc(-c2c[nH]nc2C)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268234

C[C@@H]1COCCN1c1cc(N)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM459758

CC(C)Cn1ccc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|

BDBM268236

C[C@@H]1COCCN1c1cc(-c2cn[nH]c2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268237

C[C@@H]1COCCN1c1cc(-c2ncco2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268238

Cc1nn(C)cc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268239

Cc1c(cnn1C)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268240

Cc1nn(C)c(C)c1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1 |(-1.91,-2.55,;-.58,-3.32,;-.1,-4.78,;1.44,-4.78,;2.21,-6.12,;1.91,-3.32,;3.25,-2.55,;.67,-2.41,;.67,-.87,;-.67,-.1,;-.67,1.44,;.67,2.21,;2,1.44,;3.33,2.21,;4.67,1.44,;4.67,-.1,;3.33,-.87,;2,-.1,;3.33,3.75,;2.09,4.65,;2.56,6.12,;4.1,6.12,;4.58,4.65,;-2,2.21,;-2,3.75,;-3.33,4.52,;-4.67,3.75,;-4.67,2.21,;-3.33,1.44,)|

BDBM268241

COCCS(C)(=O)=Nc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|

BDBM268242

CC(C)S(=O)(=Nc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C)c1ccc(Br)cc1 |r|

BDBM268243

C[C@@H]1COCCN1c1cc(N=S(C)(=O)c2ccccc2O)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268244

C[C@@H]1COCCN1c1cc(N=S(C)(=O)c2ccc(Br)cc2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268245

C[C@@H]1COCCN1c1cc(N=S(C)(=O)C(C)(C)C)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM268246

O=S1(CCOCC1)=Nc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268247

O=S1(CCCCC1)=Nc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM459771

CC(C)C(C)(O)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|

BDBM459772

C[C@@H]1COCCN1c1cc(c2ccnc(-c3ccn[nH]3)c2n1)C(C)(O)C1CCOCC1 |r|

BDBM459773

C[C@@H]1COCCN1c1cc(c2ccnc(-c3ccn[nH]3)c2n1)C(C)(O)C(C)(C)C |r|

BDBM459774

CCCCC(C)(O)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|

BDBM459775

C[C@@H]1COCCN1c1cc(C(N)=O)c2ccnc(-c3cc[nH]n3)c2n1 |r|

BDBM459776

C[C@@H]1COCCN1c1cc(c2ccnc(-c3ccn[nH]3)c2n1)C1(CC1)S(C)(=O)=O |r|

BDBM268254

C(Oc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1)C1CCOCC1

BDBM268255

CN(C)C(=O)c1cccc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268256

O=C(N1CCCCC1)c1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268257

CN(C)C(=O)c1ccccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268258

O=C(NC1CC1)c1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268259

Cc1ccncc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268260

C1CN(CCO1)c1cc(-c2ccc3cc[nH]c3c2)c2ccnc(-c3ccn[nH]3)c2n1

BDBM268261

C1CN(CCO1)c1cc(-c2cccc3[nH]ccc23)c2ccnc(-c3ccn[nH]3)c2n1

BDBM268262

NC(=O)c1cccc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268263

NC(=O)c1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268264

CNC(=O)c1cccc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268265

Fc1cccc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268266

Clc1ccc(s1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268267

COc1ccccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268268

FC(F)(F)c1ccccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268269

FC(F)(F)c1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268270

FC(F)(F)c1cccc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268271

Clc1cccc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268272

CC(=O)Nc1cccc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268273

COc1cccc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268274

COc1cc(OC)cc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268275

Cc1cccc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268276

COc1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268277

C(c1ccco1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM459801

Cc1cc(cc(C)c1C)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268279

Cc1cccc(c1C)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268280

OCc1cccc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268281

Fc1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268282

Clc1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268283

COc1cccc(c1F)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268284

Cc1ccccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268285

COc1cccc(c1OC)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268286

CN(C)c1cccc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268287

CN(C)c1ccccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268288

CS(=O)(=O)Nc1ccccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268289

CN(C)C(=O)c1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268290

C\C=C\c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268291

Oc1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268292

Fc1ccccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268293

O=C(N1CCCCC1)c1cccc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268294

CC(C)c1ccc(cc1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268295

O=C(NC1CC1)c1cccc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268296

C1CN(CCO1)c1cc(-c2ccc(cc2)-c2ccccc2)c2ccnc(-c3ccn[nH]3)c2n1

BDBM268297

COc1ccc(c(OC)c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268298

Clc1ccccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268299

Cc1ccc(C)c(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268300

Nc1cccc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268301

C1CN(CCO1)c1cc(-c2cccc(c2)-n2cccn2)c2ccnc(-c3ccn[nH]3)c2n1

BDBM268302

Oc1cccc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268303

COc1ccc(F)c(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268304

COc1ccc(F)cc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268305

Fc1ccc(c(F)c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268306

Fc1cccc(c1F)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268307

COc1cccc(OC)c1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1 |(-4.67,-3.49,;-3.33,-2.72,;-2,-3.49,;-2,-5.03,;-.67,-5.8,;.67,-5.03,;.67,-3.49,;2,-2.72,;3.33,-3.49,;-.67,-2.72,;-.67,-1.18,;.67,-.41,;.67,1.13,;-.67,1.9,;-2,1.13,;-3.33,1.9,;-4.67,1.13,;-4.67,-.41,;-3.33,-1.18,;-2,-.41,;-3.33,3.44,;-4.58,4.34,;-4.1,5.8,;-2.56,5.8,;-2.09,4.34,;2,1.9,;3.33,1.13,;4.67,1.9,;4.67,3.44,;3.33,4.21,;2,3.44,)|

BDBM268308

Nc1ccccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268309

Clc1cc(Cl)cc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268310

C1CN(CCO1)c1cc(-c2ccccc2-c2ccccc2)c2ccnc(-c3ccn[nH]3)c2n1

BDBM268311

Clc1cc(ccn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268312

C1CN(CCO1)c1cc(-c2cc3ccccc3s2)c2ccnc(-c3ccn[nH]3)c2n1

BDBM459836

Cn1nccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268314

C1CN(CCO1)c1cc(-c2cccc3ncccc23)c2ccnc(-c3ccn[nH]3)c2n1

BDBM268315

C1CN(CCO1)c1cc(-c2cccnc2)c2ccnc(-c3ccn[nH]3)c2n1

BDBM267990

COc1cc(ccn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268317

Cc1cncc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268318

COc1cncc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268319

C1CN(CCO1)c1cc(-c2cnc3ccccc3c2)c2ccnc(-c3ccn[nH]3)c2n1

BDBM268320

O=S(=O)(c1ccccc1)n1c(cc2ccccc12)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268321

Clc1ncccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268322

Clc1ccc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268323

OCc1ccc(s1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268324

Fc1ncccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268325

Fc1ccc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268326

Cc1ccc(c(Cl)n1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268327

COc1ncccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268328

C1CN(CCO1)c1cc(-c2cncc3ccccc23)c2ccnc(-c3ccn[nH]3)c2n1

BDBM268329

Clc1cnccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268330

Fc1cnccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268331

Fc1ccc(c(F)n1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268332

Cn1cc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268333

COc1ccc2n(C(=O)OC(C)(C)C)c(cc2c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268334

C1CN(CCO1)c1ccc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268335

Cc1cscc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268336

C1CN(CCO1)c1cc(-c2cccs2)c2ccnc(-c3ccn[nH]3)c2n1

BDBM268337

C1CN(CCO1)c1cc(-c2ccsc2)c2ccnc(-c3ccn[nH]3)c2n1

BDBM268338

Cc1ccsc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM459862

Cc1cnc(C)c(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268340

COc1ccncc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268341

COc1ncc(Cl)cc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268342

Cc1ccc2n(C(=O)OC(C)(C)C)c(cc2c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268343

Fc1ncc(Cl)cc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268344

Cc1noc(C)c1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1 |(-2,5,;-3.33,4.23,;-4.8,4.71,;-5.7,3.47,;-4.8,2.22,;-5.2,.73,;-3.33,2.69,;-2,1.93,;-2,.38,;-.67,-.38,;.67,.38,;.67,1.93,;2,2.69,;2,4.23,;.67,5,;-.67,4.23,;-.67,2.69,;3.33,1.93,;3.33,.38,;4.8,-.09,;5.7,1.15,;4.8,2.4,;-.67,-1.93,;-2,-2.69,;-2,-4.23,;-.67,-5,;.67,-4.23,;.67,-2.69,)|

BDBM268345

C1CN(CCO1)c1cc(-c2cccc3cccnc23)c2ccnc(-c3ccn[nH]3)c2n1

BDBM268346

Cc1ccc(s1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268347

CCOc1ccc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268348

CCOc1ncccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268349

C1CN(CCO1)c1cc(-c2ccc3ncccc3c2)c2ccnc(-c3ccn[nH]3)c2n1

BDBM268350

Clc1sccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268351

Nc1ccc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268352

C1CN(CCO1)c1cc(-c2cc[nH]n2)c2ccnc(-c3ccn[nH]3)c2n1

BDBM268353

Cc1ccc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268354

Cn1cccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268355

Oc1ccc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268356

Clc1cncc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268357

COc1nccc(c1Cl)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268358

Clc1ccsc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268359

Fc1cncc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268360

CSc1ncc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268361

C1CC1Nc1ncc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268362

C1CN(CCO1)c1cc(-c2cccc3cnccc23)c2ccnc(-c3ccn[nH]3)c2n1

BDBM268363

CNC(=O)c1ccc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268364

CC(C)(C)NC(=O)c1cncc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268365

CSc1cncc(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268366

C1CN(CCO1)c1cc(-c2ccnc3[nH]ccc23)c2ccnc(-c3ccn[nH]3)c2n1

BDBM268367

Nc1ncccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268368

COC(=O)c1cc(cs1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268369

COc1ncc(cc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1)C(F)(F)F

BDBM268370

CC(C)Oc1ncccc1-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268371

CCOc1ncc(cc1Cl)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268372

CC(C)(C)n1cc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268373

C1CCN(CC1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268374

OC1CCN(CC1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268375

CN(c1ccccc1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268376

CCCN(C)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268377

C1CN(CCO1)c1cc(N2CCCCCC2)c2ccnc(-c3ccn[nH]3)c2n1

BDBM268378

CC1CCCN(C1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268379

CC1CCN(CC1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268380

NC(=O)C1CCCN(C1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268381

C1C=CCN1c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1 |c:1|

BDBM268382

C1CN(c2ccccc2C1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268383

C1CN(CCO1)c1cc(N2CCc3ccccc3C2)c2ccnc(-c3ccn[nH]3)c2n1

BDBM268384

C1N(Cc2ccccc12)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM459908

C[C@@]12C[C@@H](CC(C)(C)C1)N(C2)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1 |r|

BDBM268386

CC(C)(C)OC(=O)[C@@H]1CCCN1c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1 |r|

BDBM268387

CC(C)CN(C)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268388

CN(c1cccc(F)c1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268389

O=S1(=O)CCC11CN(C1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268390

FC1CCCN(C1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268391

CN(c1ccccc1F)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM459915

NC(=O)C1CCCN1c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268393

OCC1CCN(CC1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268394

COC1CCN(CC1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268395

CN(c1ccc(F)cc1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268396

CNC(=O)[C@@H]1CCCN1c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1 |r|

BDBM268397

CCS(=O)(=O)N1CCN(CC1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268398

CS(=O)(=O)N1CCN(CC1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268399

CN(C1CC1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268400

CN(CC(C)(C)C)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268401

OC[C@H]1CCCN(C1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1 |r|

BDBM466898

CCN1CCCN(c2cc(nc(n2)-c2ccnc3[nH]ccc23)N2CCOC[C@H]2C)S1(=O)=O |r|

BDBM466899

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1CCCS1(=O)=O |r|

BDBM466900

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1CCN(C)C1=O |r|

BDBM466901

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1CCN(CC1)S(C)(=O)=O |r|

BDBM466902

C[C@@H]1COCCN1c1cc(nc(n1)-c1cc(Cl)nc2[nH]ccc12)[C@H]1CCCS1(=O)=O |r|

BDBM466904

C[C@@H]1COCCN1c1cc(nc(n1)-c1cc(Cl)nc2[nH]ccc12)[C@@H]1CCCS1(=O)=O |r|

BDBM466907

C[C@@H]1COCCN1c1cc(nc(n1)-c1cc(Cl)nc2[nH]ccc12)N1CCCN(C)S1(=O)=O |r|

BDBM466908

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)N1CCCN(C)S1(=O)=O |r|

BDBM466909

CC(C)N1CCCN(c2cc(nc(n2)-c2ccnc3[nH]ccc23)N2CCOC[C@H]2C)S1(=O)=O |r|

BDBM466910

CCN1CCCN(c2cc(nc(n2)-c2cc(Cl)nc3[nH]ccc23)N2CCOC[C@H]2C)S1(=O)=O |r|

BDBM466911

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1CCCN(C1)S(C)(=O)=O |r|

BDBM466912

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1CCN(C1)S(C)(=O)=O |r|

BDBM466913

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1CCN(CC1)C(C)=O |r|

BDBM466914

COC(=O)N1CCC(CC1)c1cc(nc(n1)-c1ccnc2[nH]ccc12)N1CCOC[C@H]1C |r|

BDBM466915

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1CCOCC1 |r|

BDBM466916

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1CCCN(C1)C(C)=O |r|

BDBM466917

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1CCN(C1)C(C)=O |r|

BDBM466918

COC(=O)N1CCC(C1)c1cc(nc(n1)-c1ccnc2[nH]ccc12)N1CCOC[C@H]1C |r|

BDBM466919

CNC(=O)N1CCC(C1)c1cc(nc(n1)-c1ccnc2[nH]ccc12)N1CCOC[C@H]1C |r|

BDBM466920

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1CCCN(C)C1=O |r|

BDBM466921

CCC(=O)N1CCC(CC1)c1cc(nc(n1)-c1ccnc2[nH]ccc12)N1CCOC[C@H]1C |r|

BDBM466922

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1CCN(CC1)C(=O)C1CC1 |r|

BDBM466923

CCOC(=O)N1CCC(CC1)c1cc(nc(n1)-c1ccnc2[nH]ccc12)N1CCOC[C@H]1C |r|

BDBM466924

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1CCN(CC1)S(=O)(=O)C1CC1 |r|

BDBM466925

COCC(=O)N1CCC(CC1)c1cc(nc(n1)-c1ccnc2[nH]ccc12)N1CCOC[C@H]1C |r|

BDBM466926

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1CCN(CC1)C(=O)CC1CC1 |r|

BDBM466927

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1CCCCS1(=O)=O |r|

BDBM466928

CC(C)OC(=O)N1CCC(CC1)c1cc(nc(n1)-c1ccnc2[nH]ccc12)N1CCOC[C@H]1C |r|

BDBM466929

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1CCN(CC1)C(=O)OCC1CC1 |r|

BDBM466930

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)C1(C)CCCS1(=O)=O |r|

BDBM466931

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)[C@]1(C)CCCS1(=O)=O |r|

BDBM466933

C[C@@H]1COCCN1c1cc(nc(n1)-c1ccnc2[nH]ccc12)[C@@]1(C)CCCS1(=O)=O |r|

BDBM478105

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(c1)-c1ccnc2[nH]ccc12 |r|

BDBM478106

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(c1)-c1ccnc2[nH]cnc12 |r|

BDBM478107

C[C@@H]1COCCN1c1cc(N=[S@](C)(=O)C2CC2)nc(c1)-c1ccnc2[nH]ccc12 |r|

BDBM478108

C[C@@H]1COCCN1c1cc(N=[S@@](C)(=O)C2CC2)nc(c1)-c1ccnc2[nH]ccc12 |r|

BDBM478109

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(c1)-n1c(C)nc2cccnc12 |r|

BDBM478110

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(c1)-n1cnc2cccnc12 |r|

BDBM478111

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(c1)-n1c(nc2ccccc12)C(F)F |r|

BDBM478112

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(c1)-n1c(CO)nc2ccccc12 |r|

BDBM478113

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(c1)-n1c(CF)nc2ccccc12 |r|

BDBM478114

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(c1)-n1c(N)nc2ccccc12 |r|

BDBM478115

CNc1nc2ccccc2n1-c1cc(cc(N=S(C)(C)=O)n1)N1CCOC[C@H]1C |r|

BDBM478116

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(c1)-n1cnc2ccccc12 |r|

BDBM478117

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(c1)-c1ccnc2[nH]c(C)cc12 |r|

BDBM478118

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(c1)-c1cncc2[nH]ccc12 |r|

BDBM478119

COc1cc(-c2cc(cc(N=S(C)(C)=O)n2)N2CCOC[C@H]2C)c2cc[nH]c2n1 |r|

BDBM478120

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(c1)-c1ccnc(N)c1 |r|

BDBM478121

C[C@@H]1COCCN1c1cc(N=S(C)(=O)C2CC2)nc(c1)-c1ccnc2[nH]ccc12 |r|

BDBM478122

C[C@@H]1COCCN1c1cc(N=S(C)(=O)C2COC2)nc(c1)-c1ccnc2[nH]ccc12 |r|

BDBM478123

CCOc1cc(-c2cc(cc(N=S(C)(C)=O)n2)N2CCOC[C@H]2C)c2cc[nH]c2n1 |r|

BDBM478124

CCOc1cc(-c2cc(cc(N=S(C)(C)=O)n2)N2CCOC[C@@H]2C)c2cc[nH]c2n1 |r|

BDBM478125

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(c1)-c1cccc2[nH]ccc12 |r|

BDBM478126

C[C@@H]1COCCN1c1cc(N=S(C)(=O)C2CC2)nc(c1)-c1cncc2[nH]ccc12 |r|

BDBM478128

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(c1)-c1cccc2[nH]cnc12 |r|

BDBM478129

C[C@@H]1COCCN1c1cc(N=S(C)(=O)C2COC2)nc(c1)-c1cncc2[nH]ccc12 |r|

BDBM478130

C[C@@H]1COCCN1c1cc(N=S2(=O)CCC2)nc(c1)-c1ccnc2[nH]ccc12 |r|

BDBM478131

C[C@@H]1COCCN1c1cc(N=S2(=O)CCCC2)nc(c1)-c1ccnc2[nH]ccc12 |r|

BDBM478133

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(c1)-c1cc(Cl)nc2[nH]ccc12 |r|

BDBM478134

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(c1)-n1c(C)nc2ccccc12 |r|

BDBM478135

CCS(=O)(CC)=Nc1cc(cc(n1)-c1ccnc2[nH]ccc12)N1CCOC[C@H]1C |r|

BDBM478138

C[C@@H]1COCCN1c1cc(N=S2(=O)CCOCC2)nc(c1)-c1ccnc2[nH]ccc12 |r|

BDBM478139

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(c1)-c1nccn1C |r|

BDBM478140

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(c1)-c1cc(F)cc2[nH]ccc12 |r|

BDBM478141

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(c1)-c1ccnn1C |r|

BDBM478143

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(c1)-c1cnn(C)c1 |r|

BDBM478144

C[C@@H]1COCCN1c1cc(N=S(C)(C)=O)nc(c1)-n1ccnc1C |r|

BDBM570423

CC[S@@](C)(=O)=Nc1cc(nc(n1)-c1ccnc2[nH]ccc12)N1CCOC[C@H]1C |r|

BDBM570425

COc1cc(cc(N)n1)-c1nc(cc(n1)N1CCOC[C@H]1C)N=[S@@](C)(=O)C1CC1 |r|

BDBM570446

C[C@@H]1COCCN1c1cc(N=[S@@](C)(=O)C2COC2)nc(n1)-n1cnc2ccccc12 |r|

BDBM570448

C[C@@H]1COCCN1c1cc(N=[S@@](C)(=O)C2CC2)nc(n1)-c1ccnc(N)c1 |r|

BDBM570452

C[C@@H]1COCCN1c1cc(N=[S@@](C)(=O)C2COC2)nc(n1)-n1c(C)nc2ccccc12 |r|

BDBM570454

C[C@@H]1COCCN1c1cc(N=[S@@](C)(=O)C2CC2)nc(n1)-c1cc(N)nc(Cl)c1 |r|

BDBM570456

C[C@@H]1COCCN1c1cc(N=[S@@](C)(=O)C2COC2)nc(n1)-c1ccnc(N)c1 |r|

BDBM570458

C[C@@H]1COCCN1c1cc(N=[S@@](C)(=O)C2CC2)nc(n1)-n1c(C)nc2ccccc12 |r|

BDBM570460

COc1cc(cc(N)n1)-c1nc(cc(n1)N1CCOC[C@H]1C)N=[S@@](C)(=O)C1COC1 |r|

BDBM570462

C[C@@H]1COCCN1c1cc(N=[S@@](C)(=O)C2CC2)nc(n1)-c1ccnc2[nH]ccc12 |r|

BDBM570477

C[C@@H]1COCCN1c1cc(N=S(C)(=O)C2CCC2)nc(n1)-c1ccnc2[nH]ccc12 |r|

BDBM570548

C[C@@H]1COCCN1c1cc(N=S(C)(=O)c2cnn(C)n2)nc(n1)-c1ccnc2[nH]ccc12 |r|

BDBM585144

C[C@@H]1COCCN1c1cc(-c2cncn2C2CC2)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM585145

C[C@@H]1COCCN1c1cc(-c2ccc(N)cc2F)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM585212

C[C@@H]1COCCN1c1cc(N2CCOC[C@H]2C)c2ccnc(-c3ccn[nH]3)c2n1 |r|

BDBM585223

C[C@@H]1COCCN1c1cc(C2CC=NN2CCF)c2ccnc(-c3ccn[nH]3)c2n1 |r,c:13|

BDBM585226

C[C@@H]1CN(CCO1)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|

BDBM585250

CSCc1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|

BDBM268194

O=C1OCCN1c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268195

C[C@@H]1COCCN1c1cc2c3ccncc3oc3cnc(-c4ccn[nH]4)c(n1)c23 |r|

BDBM268235

CC(C)Cn1cc(cn1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOC[C@H]1C |r|

BDBM268278

Cc1cc(cc(C)c1O)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM585415

C1CN(CCO1)c1cc(-c2cnc3ccccc3c2)c2cccc(-c3ccn[nH]3)c2n1

BDBM585416

O=S(=O)(c1ccccc1)n1c(cc2ccccc12)-c1cc(nc2c(cccc12)-c1ccn[nH]1)N1CCOCC1

BDBM585419

OCc1ccc(s1)-c1cc(nc2c(cccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268339

Cc1cnc(Cl)c(c1)-c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM585472

CCCC(C)c1cc(nc2c(nccc12)-c1ccn[nH]1)N1CCOCC1

BDBM268385

CC6(C)CC1CC(C)(CN1c4cc(N2CCOCC2)nc5c(c3ccn[nH]3)nccc45)C6

BDBM50465364

[H][C@@]12COC[C@@H](C)N1c1nc(nc(c1OC2)C(C)(C)S(C)(=O)=O)-c1c(NC)cnc2[nH]ccc12 |r|

BDBM50465365

[H][C@@]12COC[C@@H](C)N1c1nc(nc(c1OC2)C(C)(C)O)-c1c(NC)cnc2[nH]ccc12 |r|

BDBM50465366

[H][C@@]12COC[C@@H](C)N1c1nc(nc(c1OC2)C(C)(C)S(C)(=O)=O)-n1ccnc1NC |r|

BDBM50465367

[H][C@@]12COC[C@@H](C)N1c1nc(nc(c1OC2)C(C)(C)S(C)(=O)=O)-c1c(NCC)cnc2[nH]ccc12 |r|

BDBM50465368

[H][C@@]12COC[C@@H](C)N1c1nc(nc(c1OC2)C(C)(C)S(C)(=O)=O)N(C)c1ccn[nH]1 |r|

BDBM50465369

[H][C@@]12COC[C@@H](C)N1c1nc(nc(c1OC2)C(C)(C)S(C)(=O)=O)-n1c(NC)nc2ccccc12 |r|

BDBM50577273

OCc1cccc(c1)-c1ccc2ncc3nnc(C4CCOCC4)n3c2c1

BDBM50577274

CN(C)CCCOc1ccc(cn1)-c1ccc2ncc3nnc(C4CCOCC4)n3c2c1

BDBM50577275

FC(F)c1cccc(c1)-c1ccc2ncc3nnc(C4CCOCC4)n3c2c1

BDBM50577276

FC(F)c1ccc(cc1)-c1ccc2ncc3nnc(C4CCOCC4)n3c2c1

BDBM50577277

Clc1cccc(c1)-c1ccc2ncc3nnc(C4CCOCC4)n3c2c1

BDBM50577278

FC(F)(F)Oc1cccc(c1)-c1ccc2ncc3nnc(C4CCOCC4)n3c2c1

BDBM50577279

NS(=O)(=O)c1cccc(c1)-c1ccc2ncc3nnc(C4CCOCC4)n3c2c1

BDBM50577280

CS(=O)(=O)c1ccc(F)c(c1)-c1ccc2ncc3nnc(C4CCOCC4)n3c2c1

BDBM50577281

CS(=O)(=O)c1cccc(c1)-c1ccc2ncc3nnc(C4CCOCC4)n3c2c1

BDBM50577282

Cc1cncc(c1)-c1ccc2ncc3nnc(C4CCOCC4)n3c2c1

BDBM50577283

FC(F)c1cncc(c1)-c1ccc2ncc3nnc(C4CCOCC4)n3c2c1

BDBM50577284

NS(=O)(=O)c1cncc(c1)-c1ccc2ncc3nnc(C4CCOCC4)n3c2c1

BDBM50577285

CS(=O)(=O)c1cncc(c1)-c1ccc2ncc3nnc(C4CCOCC4)n3c2c1

BDBM50577286

FC(F)(F)c1cncc(c1)-c1ccc2ncc3nnc(C4CCOCC4)n3c2c1

BDBM50577287

Cc1cc(cnc1F)-c1ccc2ncc3nnc(C4CCOCC4)n3c2c1

BDBM50577288

Cc1nc2ccc(cc2n2c(nnc12)C1CCOCC1)-c1cncc(c1)C(F)F

BDBM50577289

FC(F)c1cncc(c1)-c1ccc2ncc3nnc(C4CCOCC4)n3c2c1F

BDBM50577290

FC(F)c1cncc(c1)-c1cc(F)c2ncc3nnc(C4CCOCC4)n3c2c1

BDBM50577291

FC(F)c1cncc(c1)-c1ccc2ncc3[nH]nc(C4CCOCC4)c3c2c1

BDBM50577292

Cn1nc(C2CCOCC2)c2c1cnc1ccc(cc21)-c1cncc(c1)C(F)F

BDBM50577293

Cn1nc2cnc3ccc(cc3c2c1C1CCOCC1)-c1cncc(c1)C(F)F

BDBM50577294

Cc1nc(C2CCOCC2)n2c1cnc1ccc(cc21)-c1cncc(c1)C(F)F

BDBM50577295

[H][C@@]12COC[C@]1([H])[C@H]2c1nnc2cnc3ccc(cc3n12)-c1cncc(c1)C(F)F |r|

BDBM50577296

FC(F)c1cncc(c1)-c1ccc2ncc3nnc(C4=CCOCC4)n3c2c1 |t:20|

BDBM50577297

FC(F)c1cncc(c1)-c1ccc2ncc3nnc(C4=CCCOCC4)n3c2c1 |t:20|

BDBM50577298

[H][C@@]12CCC[C@]1([H])[C@H]2c1nnc2cnc3ccc(cc3n12)-c1cncc(c1)C(F)F |r|

BDBM50577299

FC(F)c1cncc(c1)-c1ccc2ncc3nnc(C4=CCCCC4)n3c2c1 |t:20|

BDBM50577300

FC(F)c1cncc(c1)-c1ccc2ncc3nnc(C4=CCCCCC4)n3c2c1 |t:20|

BDBM50577301

CO[C@H]1CC[C@H](CC1)c1nnc2cnc3ccc(cc3n12)-c1cncc(c1)C(F)F |r,wU:5.8,2.1,(26.22,-45.52,;25.75,-46.98,;26.79,-48.11,;28.29,-47.78,;29.33,-48.92,;28.86,-50.39,;27.36,-50.72,;26.32,-49.58,;29.9,-51.52,;31.42,-51.35,;32.06,-52.74,;30.93,-53.78,;30.94,-55.33,;29.61,-56.11,;28.27,-55.34,;26.93,-56.12,;25.6,-55.34,;25.6,-53.8,;26.93,-53.03,;28.27,-53.79,;29.6,-53.02,;24.27,-53.03,;22.94,-53.8,;21.61,-53.04,;21.61,-51.49,;22.94,-50.72,;24.27,-51.49,;22.94,-49.19,;24.26,-48.42,;21.61,-48.42,)|

BDBM50577302

CO[C@H]1CC[C@@H](CC1)c1nnc2cnc3ccc(cc3n12)-c1cncc(c1)C(F)F |r,wU:5.8,wD:2.1,(43.27,-45.09,;42.81,-46.55,;43.84,-47.68,;43.38,-49.15,;44.41,-50.29,;45.91,-49.96,;46.38,-48.49,;45.35,-47.35,;46.95,-51.09,;48.48,-50.92,;49.11,-52.31,;47.98,-53.34,;48,-54.9,;46.66,-55.68,;45.32,-54.91,;43.99,-55.69,;42.65,-54.91,;42.66,-53.37,;43.99,-52.6,;45.32,-53.36,;46.65,-52.59,;41.32,-52.6,;40,-53.37,;38.67,-52.61,;38.66,-51.06,;39.99,-50.29,;41.33,-51.06,;39.99,-48.76,;41.32,-47.99,;38.66,-47.99,)|

BDBM50594869

C[C@@H]1COCCN1c1cc(-c2ccnn2C)c2ncc(-c3ccn[nH]3)n2n1 |r|

BDBM50594870

C[C@@H]1COCCN1c1cc(-c2ccc(C)nc2)c2ncc(-c3ccn[nH]3)n2n1 |r|

BDBM50594871

C[C@@H]1COCCN1c1nc(-c2ccnn2C)c2n(C)nc(-c3ccn[nH]3)c2n1 |r|

BDBM50594872

C[C@@H]1COCCN1c1nc(c2[nH]nc(-c3ccn[nH]3)c2n1)C(C)(C)C#N |r|

BDBM50594873

[H][C@@]12COC[C@@H](C)N1c1nc(nc(c1OC2)C1(CC1)S(C)(=N)=O)-c1ccnc2[nH]ccc12 |r|

BDBM50594874

[H][C@@]12COC[C@@H](C)N1c1nc(nc(c1OC2)C1(CC1)C#N)-c1ccnc2[nH]ccc12 |r|

BDBM50594875

C[C@@H]1COCCN1c1nc(nc2c1OC1CC2(C1)S(C)(=O)=O)-c1nncc2[nH]ccc12 |r,wU:1.0,(1.44,2.21,;.11,2.98,;.11,4.52,;-1.23,5.29,;-2.56,4.52,;-2.56,2.98,;-1.23,2.21,;-1.23,.67,;.1,-.1,;.1,-1.64,;-1.22,-2.4,;-2.56,-1.64,;-2.56,-.1,;-3.9,.68,;-5.24,-.1,;-5.24,-1.64,;-3.9,-2.42,;-3.91,-.87,;-3.9,-3.96,;-5.23,-4.73,;-3.13,-5.29,;-2.36,-3.96,;1.43,-2.41,;1.43,-3.95,;2.77,-4.71,;4.1,-3.95,;4.1,-2.4,;5.24,-1.38,;4.62,.02,;3.09,-.13,;2.77,-1.64,)|

BDBM50594876

C[C@@H]1COCCN1c1nc(nc2c1OC1CC2(C1)S(C)(=O)=O)-c1c(N)ncc2[nH]ccc12 |r,wU:1.0,(1.44,2.21,;.11,2.98,;.11,4.52,;-1.23,5.29,;-2.56,4.52,;-2.56,2.98,;-1.23,2.21,;-1.23,.67,;.1,-.1,;.1,-1.64,;-1.22,-2.4,;-2.56,-1.64,;-2.56,-.1,;-3.9,.68,;-5.24,-.1,;-5.24,-1.64,;-3.9,-2.42,;-3.91,-.87,;-3.9,-3.96,;-5.23,-4.73,;-3.13,-5.29,;-2.36,-3.96,;1.43,-2.41,;1.43,-3.95,;.1,-4.72,;2.77,-4.71,;4.1,-3.95,;4.1,-2.4,;5.24,-1.38,;4.62,.02,;3.09,-.13,;2.77,-1.64,)|

BDBM50594877

CNc1nc2ccc(F)cc2n1-c1nc(cc(n1)-c1ccnn1C)N1CCOC[C@H]1C |r|

BDBM50594878

C[C@@H]1COCCN1c1cc(nc(n1)-n1c(NCCO)nc2ccc(F)cc12)-c1ccnn1C |r|