CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00408003" in compound.

Total 1 results found.

Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

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CFAM Mol ID CFAMM00408003
Family CFFBM11271 Substance-P receptor ligand AGN-PC-03NGZP family
Superfamily CFSBM2480 Substance-P receptor and C-C chemokine receptor type 2 Binder Superfamily
Class CFCAD100 Class 100
External ID CHEMBL51417 External Source CHEMBL
PubChem CID 22293505 Functional Category Bioactive
Molecule Name AGN-PC-03NH0G
IUPAC Name 2-[3,5-bis(trifluoromethyl)phenyl]-2-[[4-[4-(4-fluorophenyl)piperidin-1-yl]-1-phenylcyclohexyl]methoxy]ethanol
Synonyms CHEBI:175064;2-[3,5-bis(trifluoromethyl)phenyl]-2-[[4-[4-(4-fluorophenyl)piperidin-1-yl]-1-phenylcyclohexyl]methoxy]ethanol
InChi InChI=1S/C34H36F7NO2/c35-29-8-6-23(7-9-29)24-12-16-42(17-13-24)30-10-14-32(15-11-30,26-4-2-1-3-5-26)22-44-31(21-43)25-18-27(33(36,37)38)20-28(19-25)34(39,40)41/h1-9,18-20,24,30-31,43H,10-17,21-22H2/t30-,31?,32+
Formula C34H36F7NO2 Molecular Weight 623.64
Cross Link CHEMBL51417

Statistics of CFAM Database

CFAM currently contains 490,279 molecules in 87,136 families, 34,880 superfamilies and 11,643 classes.

How to cite our database

C. Zhang, L. Tao, C. Qin, P. Zhang, S.Y. Chen, X. Zeng, F. Xu, Z. Chen, S.Y. Yang and Y.Z. CFam: A Chemical Families Database Based on Iterative Selection of Functional Seeds and Seed-Directed Compound Clustering. Nucl. Acids Res. 43 (D1): D558-D565 (2015) (First published online: November 20, 2014).

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