SMILES for Gag-Pol polyprotein [A364V]

76 SMILES Strings for Gag-Pol polyprotein [A364V]

Compound Name

SMILES String

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CCC(CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCN1CCC(CC1)S(C)(=O)=O |r,w:23.23,t:18,20|

BDBM372341

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCN1CCC(CC1)S(C)(=O)=O |r,t:18,20|

BDBM372342

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCN1CCC(CC1)S(C)(=O)=O |r,t:18,20|

BDBM372344

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CCC(CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCN1CCS(=O)(=O)CC1 |r,w:23.23,t:18,20|

BDBM372345

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCN1CCS(=O)(=O)CC1 |r,t:18,20|

BDBM372346

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCN1CCS(=O)(=O)CC1 |r,t:18,20|

BDBM372347

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCN1CCOCC1 |r,t:18,20|

BDBM372348

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCN1C[C@@H]2C[C@@H]1CS2(=O)=O |r,t:18,20|

BDBM372349

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCN1CCCS(=O)(=O)CC1 |r,t:18,20|

BDBM372350

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCN1CCN(CC1)S(C)(=O)=O |r,t:18,20|

BDBM372351

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCC1CCS(=O)(=O)CC1 |r,t:18,20|

BDBM372352

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NC(=O)CC1CCOCC1 |r,t:18,20|

BDBM372353

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCC1CCOCC1 |r,t:18,20|

BDBM372354

CC(=C)[C@@H]1CC[C@]2(CNCC(C)(C)N3CCS(=O)(=O)CC3)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12 |r,t:33,35|

BDBM372355

CC(=C)[C@@H]1CC[C@]2(CNCCCN3CCS(=O)(=O)CC3)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12 |r,t:32,34|

BDBM372356

CC(=C)[C@@H]1CC[C@]2(CN(CCCN3CCS(=O)(=O)CC3)C(C)=O)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12 |r,t:35,37|

BDBM372357

CCOC(=O)C1(CCN(CCN[C@]23CC[C@H]([C@@H]2[C@H]2CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]2(C)CC3)C(C)=C)CC1)C(=O)OCC |r,t:25,27|

BDBM372358

CCOC(=O)C1CS(=O)(=O)CCN1CCN[C@]12CC[C@H]([C@@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC=C(C5=CC[C@](CF)(CC5)C(O)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2)C(C)=C |r,w:5.4,t:30,32|

BDBM372360

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCN1CCC(CC1)(C(O)=O)C(O)=O |r,t:18,20|

BDBM372361

CCOC(=O)C1(CCN(CCN[C@]23CC[C@H]([C@@H]2[C@H]2CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]2(C)CC3)C(C)=C)CC1)C(O)=O |r,t:25,27|

BDBM372362

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCN1CCSCC1C(O)=O |r,w:48.55,t:18,20|

BDBM372363

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCO |r,t:18,20|

BDBM372364

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCN1CCCC1=O |r,t:18,20|

BDBM372365

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCCN1CCCC1=O |r,t:18,20|

BDBM372366

CC(C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCN1CCS(=O)(=O)CC1 |r,t:18,20|

BDBM372368

CC(C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6CC[C@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCN1CCS(=O)(=O)CC1 |r,wU:34.36,14.13,39.44,37.41,15.15,6.45,23.23,wD:11.11,3.2,9.9,23.28,t:18,(1.83,6.84,;1.06,5.51,;-.48,5.51,;1.83,4.17,;3.36,4.33,;3.98,2.93,;2.84,1.9,;2.84,.36,;1.51,-.41,;.17,.36,;.17,-1.18,;.17,1.9,;-1.16,2.67,;-2.49,1.9,;-2.49,.36,;-3.83,-.41,;-3.83,1.13,;-5.16,.36,;-6.5,-.41,;-6.5,-1.95,;-7.83,-2.72,;-9.16,-1.95,;-10.5,-2.72,;-10.5,-4.26,;-11.98,-3.87,;-12.38,-2.38,;-9.16,-5.03,;-7.83,-4.26,;-10.89,-5.75,;-12.38,-6.15,;-9.81,-6.84,;-5.16,-2.72,;-5.93,-4.06,;-4.39,-4.06,;-3.83,-1.95,;-2.49,-2.72,;-1.16,-1.95,;-1.16,-.41,;-1.16,1.13,;1.51,2.67,;4.17,1.13,;5.51,.36,;6.84,1.13,;8.18,.36,;8.18,-1.18,;9.51,-1.95,;10.84,-1.18,;12.38,-1.18,;11.61,-2.52,;10.84,.36,;9.51,1.13,)|

BDBM372369

CC1CN(CCN[C@]23CC[C@H]([C@@H]2[C@H]2CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@](CF)(CC6)OC=O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]2(C)CC3)C(C)=C)CC(C)S1(=O)=O |r,t:20,22|

BDBM372370

CC1CN(CCN[C@]23CC[C@H]([C@@H]2[C@H]2CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)OC=O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]2(C)CC3)C(C)=C)CC(C)S1(=O)=O |r,t:20,22|

BDBM372371

CC1CN(CCN[C@]23CC[C@H]([C@@H]2[C@H]2CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@](CF)(CC6)OC=O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]2(C)CC3)C(C)=C)CCS(=O)(=O)C1 |r,t:20,22|

BDBM372372

CC1CN(CCN[C@]23CC[C@H]([C@@H]2[C@H]2CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)OC=O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]2(C)CC3)C(C)=C)CCS(=O)(=O)C1 |r,t:20,22|

BDBM372373

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCC(O)=O |r,t:18,20|

BDBM372374

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCC(=O)N1CCS(=O)(=O)CC1 |r,t:18,20|

BDBM372375

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCC(=O)N1CCC(C)(O)CC1 |r,t:18,20|

BDBM372376

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCC(=O)N1CCC(CC1)S(C)(=O)=O |r,t:18,20|

BDBM372377

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCC(=O)N1CCOCC1 |r,t:18,20|

BDBM372378

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCC(=O)N1CCN(CC1)S(C)(=O)=O |r,t:18,20|

BDBM372379

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCC(=O)N1CCCS(=O)(=O)CC1 |r,t:18,20|

BDBM372380

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCC(=O)N1CCS(=O)(=O)C1 |r,t:18,20|

BDBM372381

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCC(=O)N1CCC(C1)S(C)(=O)=O |r,t:18,20|

BDBM372382

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCC(=O)N1C[C@@H]2C[C@H]1CS2(=O)=O |r,t:18,20,TLB:42:44:47:49.50|

BDBM372383

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(=O)NCCN1CCS(=O)(=O)CC1 |r,t:18,20|

BDBM372384

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NC(CN)C(F)(F)F |r,t:18,20|

BDBM372386

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NC(CN1CCS(=O)(=O)CC1)C(F)(F)F |r,t:18,20|

BDBM372388

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCS(=O)(=O)CCN1CCS(=O)(=O)CC1 |r,t:18,20|

BDBM372389

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCC(C)(C)O |r,t:18,20|

BDBM372390

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCC(C)(C)O |r,t:18,20|

BDBM372391

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCCC(C)(C)O |r,t:18,20|

BDBM372392

CCC(O)(CC)CCN[C@]12CC[C@H]([C@@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC=C(C5=CC[C@@](CF)(CC5)C(O)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2)C(C)=C |r,t:22,24|

BDBM372393

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(=O)OCc6ccccc6)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCC(O)(C1CC1)C1CC1 |r,t:18,20|

BDBM372394

[#6]-[#6](=[#6])-[#6@@H]-1-[#6]-[#6][C@@]2([#6]-[#6][C@]3([#6])[#6@H](-[#6]-[#6]-[#6@@H]4[C@@]5([#6])[#6]-[#6]=[#6](-[#6]-6=[#6]-[#6][C@@]([#6]F)([#6]-[#6]-6)[#6](-[#8])=O)C([#6])([#6])[#6@@H]5-[#6]-[#6][C@@]34[#6])-[#6@@H]-12)[#7]-[#6]\[#6]=[#6](/[#6]-1-[#6]-[#6]1)-[#6]-1-[#6]-[#6]-1 |r,t:18,20|

BDBM372395

CC(C)CCN[C@]12CC[C@H]([C@@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC=C(C5=CC[C@@](CF)(CC5)C(O)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2)C(C)=C |r,t:19,21|

BDBM372396

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCC(O)CN1CCS(=O)(=O)CC1 |r,t:18,20|

BDBM372397

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCC1(O)CCC1 |r,t:18,20|

BDBM372398

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCC1(O)COC1 |r,t:18,20|

BDBM372399

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCC1(O)COC1 |r,t:18,20|

BDBM372400

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCC1(O)CCOCC1 |r,t:18,20|

BDBM372401

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCC1(O)CCS(=O)(=O)CC1 |r,t:18,20|

BDBM372402

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCC1(O)CCN(CC1)S(C)(=O)=O |r,t:18,20|

BDBM372403

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCC1(O)CCN(CC1)C(C)=O |r,t:18,20|

BDBM372404

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCC[C@@]1(O)CC[C@@](C)(O)CC1 |r,wU:34.36,14.13,39.44,37.41,15.15,6.45,23.28,47.53,43.49,wD:11.11,3.2,9.9,23.23,43.48,47.54,t:18,20,(1.25,6.84,;.85,5.35,;-.64,4.95,;1.94,4.26,;3.47,4.42,;4.09,3.02,;2.95,1.99,;2.95,.45,;1.62,-.32,;.28,.45,;.28,-1.09,;.28,1.99,;-1.05,2.76,;-2.39,1.99,;-2.39,.45,;-3.72,-.32,;-3.72,1.22,;-5.05,.45,;-6.39,-.32,;-6.39,-1.86,;-7.72,-2.63,;-9.05,-1.86,;-10.39,-2.63,;-10.39,-4.17,;-11.72,-3.4,;-11.72,-1.86,;-9.05,-4.94,;-7.72,-4.17,;-11.16,-5.51,;-12.7,-5.51,;-10.39,-6.84,;-5.05,-2.63,;-5.82,-3.97,;-4.28,-3.97,;-3.72,-1.86,;-2.39,-2.63,;-1.05,-1.86,;-1.05,-.32,;-1.05,1.22,;1.62,2.76,;4.28,1.22,;5.62,1.99,;6.95,1.22,;8.28,1.99,;6.95,2.76,;9.05,.65,;10.59,.65,;11.36,1.99,;12.7,2.76,;12.7,1.22,;10.59,3.32,;9.05,3.32,)|

BDBM372405

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCC[C@@]1(O)CC[C@@](C)(O)CC1 |r,wU:34.36,14.13,39.44,37.41,15.15,6.45,23.23,47.53,43.49,wD:11.11,3.2,9.9,23.28,43.48,47.54,t:18,20,(1.38,6.79,;.98,5.31,;-.51,4.91,;2.07,4.22,;3.6,4.38,;4.23,2.97,;3.08,1.94,;3.08,.4,;1.75,-.37,;.42,.4,;.42,-1.14,;.42,1.94,;-.92,2.71,;-2.25,1.94,;-2.25,.4,;-3.59,-.37,;-3.59,1.17,;-4.92,.4,;-6.25,-.37,;-6.25,-1.91,;-7.59,-2.68,;-8.92,-1.91,;-10.25,-2.68,;-10.25,-4.22,;-10.65,-5.71,;-9.56,-6.79,;-8.92,-4.99,;-7.59,-4.22,;-11.74,-3.82,;-12.83,-4.91,;-12.14,-2.33,;-4.92,-2.68,;-5.69,-4.01,;-4.15,-4.01,;-3.59,-1.91,;-2.25,-2.68,;-.92,-1.91,;-.92,-.37,;-.92,1.17,;1.75,2.71,;4.42,1.17,;5.75,1.94,;7.08,1.17,;8.42,1.94,;7.08,2.71,;9.19,.61,;10.73,.61,;11.5,1.94,;12.83,2.71,;12.83,1.17,;10.73,3.28,;9.19,3.28,)|

BDBM372406

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCC[C@]1(O)CC[C@@](C)(O)CC1 |r,wU:34.36,14.13,39.44,37.41,15.15,6.45,23.28,43.49,47.54,wD:11.11,3.2,9.9,23.23,43.48,47.53,t:18,20,(1.25,6.84,;.85,5.35,;-.64,4.95,;1.94,4.26,;3.47,4.42,;4.09,3.02,;2.95,1.99,;2.95,.45,;1.62,-.32,;.28,.45,;.28,-1.09,;.28,1.99,;-1.05,2.76,;-2.39,1.99,;-2.39,.45,;-3.72,-.32,;-3.72,1.22,;-5.05,.45,;-6.39,-.32,;-6.39,-1.86,;-7.72,-2.63,;-9.05,-1.86,;-10.39,-2.63,;-10.39,-4.17,;-11.72,-3.4,;-11.72,-1.86,;-9.05,-4.94,;-7.72,-4.17,;-11.16,-5.51,;-12.7,-5.51,;-10.39,-6.84,;-5.05,-2.63,;-5.82,-3.97,;-4.28,-3.97,;-3.72,-1.86,;-2.39,-2.63,;-1.05,-1.86,;-1.05,-.32,;-1.05,1.22,;1.62,2.76,;4.28,1.22,;5.62,1.99,;6.95,1.22,;8.28,1.99,;6.95,2.76,;9.05,3.32,;10.59,3.32,;11.36,1.99,;12.7,1.22,;12.7,2.76,;10.59,.65,;9.05,.65,)|

BDBM372407

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCC[C@@]1(O)CC[C@@H](CC1)S(C)(=O)=O |r,wU:34.36,14.13,39.44,37.41,15.15,6.45,23.28,43.49,47.56,wD:11.11,3.2,9.9,23.23,43.48,t:18,20,(.58,6.84,;.18,5.35,;-1.31,4.95,;1.27,4.26,;2.8,4.42,;3.43,3.02,;2.28,1.99,;2.28,.45,;.95,-.32,;-.38,.45,;-.38,-1.09,;-.38,1.99,;-1.72,2.76,;-3.05,1.99,;-3.05,.45,;-4.39,-.32,;-4.39,1.22,;-5.72,.45,;-7.05,-.32,;-7.05,-1.86,;-8.39,-2.63,;-9.72,-1.86,;-11.05,-2.63,;-11.05,-4.17,;-12.39,-3.4,;-12.39,-1.86,;-9.72,-4.94,;-8.39,-4.17,;-11.82,-5.51,;-13.36,-5.51,;-11.05,-6.84,;-5.72,-2.63,;-6.49,-3.97,;-4.95,-3.97,;-4.39,-1.86,;-3.05,-2.63,;-1.72,-1.86,;-1.72,-.32,;-1.72,1.22,;.95,2.76,;3.62,1.22,;4.95,1.99,;6.28,1.22,;7.62,1.99,;6.28,2.76,;8.39,.65,;9.93,.65,;10.7,1.99,;9.93,3.32,;8.39,3.32,;12.03,2.76,;13.36,1.99,;11.26,4.09,;12.8,4.09,)|

BDBM372408

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCC[C@@]1(O)CC[C@@H](CC1)S(C)(=O)=O |r,wU:34.36,14.13,39.44,37.41,15.15,6.45,23.23,43.49,47.56,wD:11.11,3.2,9.9,23.28,43.48,t:18,20,(.71,6.79,;.31,5.31,;-1.17,4.91,;1.4,4.22,;2.93,4.38,;3.56,2.97,;2.42,1.94,;2.42,.4,;1.08,-.37,;-.25,.4,;-.25,-1.14,;-.25,1.94,;-1.59,2.71,;-2.92,1.94,;-2.92,.4,;-4.25,-.37,;-4.25,1.17,;-5.59,.4,;-6.92,-.37,;-6.92,-1.91,;-8.25,-2.68,;-9.59,-1.91,;-10.92,-2.68,;-10.92,-4.22,;-11.32,-5.71,;-10.23,-6.79,;-9.59,-4.99,;-8.25,-4.22,;-12.41,-3.82,;-13.5,-4.91,;-12.81,-2.33,;-5.59,-2.68,;-6.36,-4.01,;-4.82,-4.01,;-4.25,-1.91,;-2.92,-2.68,;-1.59,-1.91,;-1.59,-.37,;-1.59,1.17,;1.08,2.71,;3.75,1.17,;5.08,1.94,;6.42,1.17,;7.75,1.94,;6.42,2.71,;8.52,.61,;10.06,.61,;10.83,1.94,;10.06,3.28,;8.52,3.28,;12.16,2.71,;13.5,1.94,;11.39,4.05,;12.93,4.05,)|

BDBM372409

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCC[C@]1(O)CC[C@@H](CC1)S(C)(=O)=O |r,wU:34.36,14.13,39.44,37.41,15.15,6.45,23.28,43.49,wD:11.11,3.2,9.9,23.23,43.48,47.56,t:18,20,(.58,6.84,;.18,5.35,;-1.31,4.95,;1.27,4.26,;2.8,4.42,;3.43,3.02,;2.28,1.99,;2.28,.45,;.95,-.32,;-.38,.45,;-.38,-1.09,;-.38,1.99,;-1.72,2.76,;-3.05,1.99,;-3.05,.45,;-4.39,-.32,;-4.39,1.22,;-5.72,.45,;-7.05,-.32,;-7.05,-1.86,;-8.39,-2.63,;-9.72,-1.86,;-11.05,-2.63,;-11.05,-4.17,;-12.39,-3.4,;-12.39,-1.86,;-9.72,-4.94,;-8.39,-4.17,;-11.82,-5.51,;-13.36,-5.51,;-11.05,-6.84,;-5.72,-2.63,;-6.49,-3.97,;-4.95,-3.97,;-4.39,-1.86,;-3.05,-2.63,;-1.72,-1.86,;-1.72,-.32,;-1.72,1.22,;.95,2.76,;3.62,1.22,;4.95,1.99,;6.28,1.22,;7.62,1.99,;6.28,2.76,;8.39,3.32,;9.93,3.32,;10.7,1.99,;9.93,.65,;8.39,.65,;12.03,1.22,;13.36,1.99,;11.26,-.12,;12.8,-.12,)|

BDBM372410

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCC1(O)CCC(CC1)OS(C)(=O)=O |r,wU:34.36,14.13,39.44,37.41,15.15,6.45,23.28,wD:11.11,3.2,9.9,23.23,t:18,20,(-.01,6.84,;-.41,5.35,;-1.9,4.95,;.68,4.26,;2.21,4.42,;2.84,3.02,;1.69,1.99,;1.69,.45,;.36,-.32,;-.98,.45,;-.98,-1.09,;-.98,1.99,;-2.31,2.76,;-3.64,1.99,;-3.64,.45,;-4.98,-.32,;-4.98,1.22,;-6.31,.45,;-7.64,-.32,;-7.64,-1.86,;-8.98,-2.63,;-10.31,-1.86,;-11.65,-2.63,;-11.65,-4.17,;-12.98,-3.4,;-12.98,-1.86,;-10.31,-4.94,;-8.98,-4.17,;-12.42,-5.51,;-13.96,-5.51,;-11.65,-6.84,;-6.31,-2.63,;-7.08,-3.97,;-5.54,-3.97,;-4.98,-1.86,;-3.64,-2.63,;-2.31,-1.86,;-2.31,-.32,;-2.31,1.22,;.36,2.76,;3.02,1.22,;4.36,1.99,;5.69,1.22,;7.03,1.99,;5.69,2.76,;7.8,.65,;9.34,.65,;10.11,1.99,;9.34,3.32,;7.8,3.32,;11.65,1.99,;12.42,.65,;13.96,.65,;12.42,-.89,;11.08,-.12,)|

BDBM372411

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCN1CCC(C)(O)CC1 |r,t:18,20|

BDBM372412

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCN1CCOC1=O |r,t:18,20|

BDBM372413

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCN1CCNC1=O |r,t:18,20|

BDBM372414

CN1CCN(CCN[C@]23CC[C@H]([C@@H]2[C@H]2CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]2(C)CC3)C(C)=C)C1=O |r,t:21,23|

BDBM372415

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCN1CCN(C(C)=O)C(C)(C)C1=O |r,t:18,20|

BDBM372416

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CCC(F)(CC6)OC=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCN1CCC(CC1)S(C)(=O)=O |r,t:18,20|

BDBM372417

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CCC(C)(CC6)OC=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCN1CCS(=O)(=O)CC1 |r,t:18,20|

BDBM372418

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CCC(CF)(CC6)OC=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCN1CCS(=O)(=O)CC1 |r,t:18,20|

BDBM372419

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@@](CF)(CC6)OC=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCN1CCS(=O)(=O)CC1 |r,t:18,20|

BDBM372420

CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(C6=CC[C@](CF)(CC6)OC=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)NCCN1CCS(=O)(=O)CC1 |r,t:18,20|