CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00212981" 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 CFAMM00212981
Family CFFID530 Vasopressin V1a receptor Ligand Sr 49059 Family
Superfamily CFSID428 Vasopressin V1a receptor Ligand Sr 49059 Superfamily
Class CFCCD326 Class 1139
External ID 23368640 External Source PubChem
PubChem CID 23368640 Functional Category Patent Compound
Molecule Name AGN-PC-041ZXI
IUPAC Name 5-chloro-3-(2-chlorophenyl)-1-(3,4-dimethoxyphenyl)sulfonyl-3-hydroxy-N-methyl-N-(1-methylpiperidin-4-yl)-2H-indole-2-carboxamide
Synonyms SureCN8989889;5-chloro-3-(2-chlorophenyl)-1-(3,4-dimethoxyphenyl)sulfonyl-3-hydroxy-N-methyl-N-(1-methylpiperidin-4-yl)-2H-indole-2-carboxamide
InChi InChI=1S/C30H33Cl2N3O6S/c1-33-15-13-20(14-16-33)34(2)29(36)28-30(37,22-7-5-6-8-24(22)32)23-17-19(31)9-11-25(23)35(28)42(38,39)21-10-12-26(40-3)27(18-21)41-4/h5-12,17-18,20,28,37H,13-16H2,1-4H3
InChiKey AYNZWVRNJSAOKH-UHFFFAOYSA-N
Formula C30H33Cl2N3O6S Molecular Weight 634.57
Cross Link
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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