CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00434542" 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.

Search Results

CFAM Mol ID CFAMM00434542
Family CFFBM15524 Vasopressin V2 receptor and Vasopressin V1a receptor ligand SureCN8315047 family
Superfamily CFSCD247 Calcium-activated potassium channel subunit alpha-1 Ligand AVE0118 Superfamily
Class CFCAD656 Class 656
External ID CHEMBL351019 External Source CHEMBL
PubChem CID 44378885 Functional Category Bioactive
Molecule Name N-[3-methoxy-4-[9-[(4-methylpiperazin-1-yl)methyl]-6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepine-5-carbonyl]phenyl]-2-phenylbenzamide
IUPAC Name N-[3-methoxy-4-[9-[(4-methylpiperazin-1-yl)methyl]-6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepine-5-carbonyl]phenyl]-2-phenylbenzamide
Synonyms AGN-PC-0755V3;CHEBI:376907;N-[3-methoxy-4-[9-[(4-methylpiperazin-1-yl)methyl]-6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepine-5-carbonyl]phenyl]-2-phenylbenzamide
InChi InChI=1S/C39H39N5O3/c1-41-20-22-42(23-21-41)26-31-17-18-32-27-44(36-15-9-6-12-29(36)25-43(31)32)39(46)35-19-16-30(24-37(35)47-2)40-38(45)34-14-8-7-13-33(34)28-10-4-3-5-11-28/h3-19,24H,20-23,25-27H2,1-2H3,(H,40,45)
InChiKey SUAPLVPXYIPBOE-UHFFFAOYSA-N
Formula C39H39N5O3 Molecular Weight 625.76
Cross Link CHEMBL351019
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
 

 

26844 visits since 2014 .........

 



Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


All rights reserved.

   
 
 
Computer-aided Drug Design
about BIDD |  databases |  software |  teaching |  research |  links

 

Department of Computational Science | National University of Singapore | Blk S17, 3 Science Drive 2, Singapore 117543

hdnkeywordtype:MiniFieldStorage('hdnkeywordtype', 'compound'),None, hdnkeywordtype, compound|txtsearch:MiniFieldStorage('txtsearch', 'CFAMM00434542'),None, txtsearch, CFAMM00434542|