BDBM56451 (5S)-17-(1-hydroxyethyl)-10,13-dimethyl-3-spiro[1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-12,2'-1,3-dioxolane]ol::(5S)-17-(1-hydroxyethyl)-10,13-dimethyl-spiro[1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-12,2'-1,3-dioxolane]-3-ol::(5S)-17-(1-hydroxyethyl)-10,13-dimethylspiro[1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-12,2'-1,3-dioxolane]-3-ol::(5alpha)-spiro[pregnane-12,2'-(1,3)-dioxolane]-3,20-diol::MLS000325142::SMR000160935::cid_11948808

SMILES CC(O)C1CCC2C3CC[C@H]4CC(O)CCC4(C)C3CC3(OCCO3)C12C

InChI Key InChIKey=RVGDDNFEWDRBHC-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 = 56451   

TargetKallikrein-5(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM56451((5S)-17-(1-hydroxyethyl)-10,13-dimethylspiro[1,2,3...)
Affinity DataIC50: 5.00E+4nMAssay Description:Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Scott L. Diamond, University of Pennsy...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/8/2011
Entry Details
PCBioAssay