CFam Chemical Families Database
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You are searching for "CFAMM00385458" in compound.

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CFAM Mol ID CFAMM00385458
Family CFFBM8096 C-C chemokine receptor type 5 ligand [4-[2-[3-(2-ethylbenzimidazol-1-yl)-8-azabicyclo[3.2.1]octan-8-yl]ethyl]-4-phenylpiperidin-1-yl]-phenylmethanone family
Superfamily CFSBM4401 Histamine H3 receptor and C-C chemokine receptor type 5 Binder Superfamily
Class CFCID1689 Class 3039
External ID CHEMBL312141 External Source CHEMBL
PubChem CID 44315267 Functional Category Bioactive
Molecule Name 3,5-dichloro-N-cyclopropyl-N-[(2Z,3R)-3-(3,4-dichlorophenyl)-2-methoxyimino-5-[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]pentyl]benzamide
IUPAC Name 3,5-dichloro-N-cyclopropyl-N-[(2Z,3R)-3-(3,4-dichlorophenyl)-2-methoxyimino-5-[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]pentyl]benzamide
Synonyms CHEBI:222328
InChi InChI=1S/C34H35Cl4N5O3/c1-46-40-31(20-42(25-7-8-25)33(44)22-16-23(35)19-24(36)17-22)27(21-6-9-28(37)29(38)18-21)12-15-41-13-10-26(11-14-41)43-32-5-3-2-4-30(32)39-34(43)45/h2-6,9,16-19,25-27H,7-8,10-15,20H2,1H3,(H,39,45)/b40-31+/t27-/m1/s1
InChiKey HSRXPFPQSJNQHE-FFYHKUAESA-N
Formula C34H35Cl4N5O3 Molecular Weight 703.49
Cross Link CHEMBL312141
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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