CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00441245" 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 CFAMM00441245
Family CFFBM17232 Acetylcholinesterase and Cholinesterase inhibitor AGN-PC-04X9O4 family
Superfamily CFSBM3773 5-hydroxytryptamine receptor 1A and Prelamin-A/C Binder Superfamily
Class CFCAD216 Class 216
External ID CHEMBL450553 External Source CHEMBL
PubChem CID 25149265 Functional Category Bioactive
Molecule Name AGN-PC-04X9O4
IUPAC Name
Synonyms CHEBI:616862
InChi InChI=1S/C46H56N4O6/c1-5-47(31-33-19-11-13-21-39(33)55-3)27-15-7-9-17-29-49-43(51)35-23-25-37-42-38(26-24-36(41(35)42)44(49)52)46(54)50(45(37)53)30-18-10-8-16-28-48(6-2)32-34-20-12-14-22-40(34)56-4/h11-14,19-26H,5-10,15-18,27-32H2,1-4H3
InChiKey LMHQZKRKCUDJFH-UHFFFAOYSA-N
Formula C46H56N4O6 Molecular Weight 760.96
Cross Link CHEMBL450553
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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