BDBM100165 2-[(1S,3R,12bS)-10-(2-furanyl)-4-oxo-1-[oxo(1-piperidinyl)methyl]-12b-(2-phenylethyl)-1,2,3,6,7,12-hexahydroindolo[2,3-a]quinolizin-3-yl]-N-[2-(4-morpholinyl)ethyl]acetamide::2-[(1S,3R,12bS)-10-(2-furyl)-4-keto-12b-phenethyl-1-(piperidine-1-carbonyl)-1,2,3,6,7,12-hexahydropyrido[2,1-a]-carbolin-3-yl]-N-(2-morpholinoethyl)acetamide::2-[(1S,3R,12bS)-10-(furan-2-yl)-4-oxidanylidene-12b-(2-phenylethyl)-1-piperidin-1-ylcarbonyl-1,2,3,6,7,12-hexahydroindolo[2,3-a]quinolizin-3-yl]-N-(2-morpholin-4-ylethyl)ethanamide::2-[(1S,3R,12bS)-10-(furan-2-yl)-4-oxo-12b-(2-phenylethyl)-1-(piperidine-1-carbonyl)-1,2,3,6,7,12-hexahydroindolo[2,3-a]quinolizin-3-yl]-N-(2-morpholin-4-ylethyl)acetamide::MLS002642829::SMR001551211::cid_44602141

SMILES O=C(C[C@H]1C[C@H](C(=O)N2CCCCC2)[C@]2(CCc3ccccc3)N(CCc3c2[nH]c2cc(ccc32)-c2ccco2)C1=O)NCCN1CCOCC1

InChI Key InChIKey=KGOYVAWWNZPSHA-UHFFFAOYSA-N

Data  1 EC50

  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 = 100165   

TargetKallikrein-7(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM100165(2-[(1S,3R,12bS)-10-(furan-2-yl)-4-oxidanylidene-12...)
Affinity DataEC50:  8.82E+3nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/18/2013
Entry Details
PCBioAssay