CFam Chemical Families Database
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You are searching for "CFAMM00225113" 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 CFAMM00225113
Family CFFID1018 Carbonic anhydrase 2 Inhibitor N-[2-(1h-indol-5-yl)-butyl]-4-sulfamoyl-benzamide Family
Superfamily CFSCD741 C-C chemokine receptor type 9 Ligand Vercirnon Superfamily
Class CFCCD527 Class 1340
External ID CHEMBL351755 External Source CHEMBL
PubChem CID 44372393 Functional Category Bioactive
Molecule Name SureCN6166035
IUPAC Name 2-(3-carbamimidoylphenyl)-N-[4-(2-sulfamoylphenyl)phenyl]pyridine-3-carboxamide;2,2,2-trifluoroacetic acid
Synonyms CHEBI:363174
InChi InChI=1S/C25H21N5O3S.C2HF3O2/c26-24(27)18-6-3-5-17(15-18)23-21(8-4-14-29-23)25(31)30-19-12-10-16(11-13-19)20-7-1-2-9-22(20)34(28,32)33;3-2(4,5)1(6)7/h1-15H,(H3,26,27)(H,30,31)(H2,28,32,33);(H,6,7)
InChiKey MYPSYCRELCNXMW-UHFFFAOYSA-N
Formula C25H21N5O3S.C2HF3O2 Molecular Weight 585.55
Cross Link CHEMBL351755
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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