CFAM Mol ID	CFAMM00336381
Family	CFFBM2654 C-C chemokine receptor type 2 and Potassium voltage-gated channel subfamily H member 2 ligand N-[2-[[(3S,4S)-4-ethoxy-1-(4-phenylcyclohexyl)pyrrolidin-3-yl]amino]-2-oxoethyl]-3-(trifluoromethyl)benzamide family
Superfamily	CFSID981 Plasmepsin-2 Inhibitor PS-222036 Superfamily
Class	CFCID676 Class 2026
External ID	CHEMBL1290637	External Source	CHEMBL
PubChem CID	52941377	Functional Category	Bioactive
Molecule Name	N-[2-oxo-2-[[(3S,4S)-1-(4-phenylcyclohexyl)-4-propoxypyrrolidin-3-yl]amino]ethyl]-3-(trifluoromethyl)benzamide
IUPAC Name	N-[2-oxo-2-[[(3S,4S)-1-(4-phenylcyclohexyl)-4-propoxypyrrolidin-3-yl]amino]ethyl]-3-(trifluoromethyl)benzamide
Synonyms	CHEBI:817055
InChi	InChI=1S/C29H36F3N3O3/c1-2-15-38-26-19-35(24-13-11-21(12-14-24)20-7-4-3-5-8-20)18-25(26)34-27(36)17-33-28(37)22-9-6-10-23(16-22)29(30,31)32/h3-10,16,21,24-26H,2,11-15,17-19H2,1H3,(H,33,37)(H,34,36)/t21-,24+,25-,26-/m0/s1
InChiKey	SQAGKRMXWWHHJT-QUKDMSEQSA-N
Formula	C29H36F3N3O3	Molecular Weight	531.61
Cross Link	CHEMBL1290637
Structure

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).

Last update by

2014.08.29

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Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore

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