BDBM45522 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-[(3-methoxyphenyl)methylamino]-3-oxopropanoic acid ethyl ester::2-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-3-keto-3-(m-anisylamino)propionic acid ethyl ester::MLS000327002::SMR000179556::cid_3715060::ethyl 2-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-3-[(3-methoxyphenyl)methylamino]-3-oxidanylidene-propanoate::ethyl 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-[(3-methoxybenzyl)amino]-3-oxopropanoate::ethyl 2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-3-[(3-methoxyphenyl)methylamino]-3-oxopropanoate

SMILES CCOC(=O)C(C(=O)NCc1cccc(OC)c1)c1ncc(cc1Cl)C(F)(F)F

InChI Key InChIKey=CXDSUTPRHKIHHA-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 = 45522   

TargetCoagulation factor XII(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM45522(SMR000179556 | 2-[3-chloro-5-(trifluoromethyl)-2-p...)
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:
5/27/2011
Entry Details
PCBioAssay