CFam Chemical Families Database
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You are searching for "CFAMM00418033" in compound.

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CFAM Mol ID CFAMM00418033
Family CFFBM12747 Substance-P receptor and Sodium-dependent serotonin transporter ligand N,N-diethyl-6-[[4-(4-fluorophenyl)-1-methylpiperidin-4-yl]methoxymethyl]-4-(trifluoromethyl)pyridin-2-amine family
Superfamily CFSBM5168 Substance-P receptor and Nitric oxide synthase, brain Binder Superfamily
Class CFCID1495 Class 2845
External ID CHEMBL2333624 External Source CHEMBL
PubChem CID 24801458 Functional Category Bioactive
Molecule Name 2-[(1-methyl-4-phenylpiperidin-4-yl)methoxymethyl]-6-pyrrolidin-1-yl-4-(trifluoromethyl)pyridine
IUPAC Name 2-[(1-methyl-4-phenylpiperidin-4-yl)methoxymethyl]-6-pyrrolidin-1-yl-4-(trifluoromethyl)pyridine
Synonyms AGN-PC-04RLVK;SureCN12050239;2-[(1-methyl-4-phenylpiperidin-4-yl)methoxymethyl]-6-pyrrolidin-1-yl-4-(trifluoromethyl)pyridine
InChi InChI=1S/C24H30F3N3O/c1-29-13-9-23(10-14-29,19-7-3-2-4-8-19)18-31-17-21-15-20(24(25,26)27)16-22(28-21)30-11-5-6-12-30/h2-4,7-8,15-16H,5-6,9-14,17-18H2,1H3
InChiKey JOTAAZWGDRXATN-UHFFFAOYSA-N
Formula C24H30F3N3O Molecular Weight 433.51
Cross Link CHEMBL2333624
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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