BDBM41223 (3S,3'aR,8'aS,8'bS)-2'-benzyl-5-chloro-7-methylspiro[1H-indole-3,4'-3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine]-1',2,3'-trione::(3S,3'aR,8'aS,8'bS)-5-chloranyl-7-methyl-2'-(phenylmethyl)spiro[1H-indole-3,4'-3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine]-1',2,3'-trione::(3S,3'aR,8'aS,8'bS)-5-chloro-7-methyl-2'-(phenylmethyl)spiro[1H-indole-3,4'-3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine]-1',2,3'-trione::(3aR,4S,8aS,8bS)-2-benzyl-5'-chloro-7'-methyl-spiro[3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine-4,3'-indoline]-1,2',3-trione::MLS000042292::SMR000047300::cid_5389991

SMILES Cc1cc(Cl)cc2c1NC(=O)[C@]21[C@H]2[C@@H]([C@@H]3CCCN13)C(=O)N(Cc1ccccc1)C2=O

InChI Key InChIKey=KPCDIXZQWAGUSI-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 41223   

TargetDNA-directed RNA polymerase subunit beta(Escherichia coli)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM41223(SMR000047300 | (3S,3'aR,8'aS,8'bS)-5-chloranyl-7-m...)
Affinity DataIC50: 5.00E+4nMAssay Description:Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/11/2011
Entry Details
PCBioAssay