CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00333821" in compound.

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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 CFAMM00333821
Family CFFBM2422 MAP kinase-activated protein kinase 2 and Mitogen-activated protein kinase 9 inhibitor CHEMBL1801374 family
Superfamily CFSBM331 Cathepsin K and Histamine H3 receptor Binder Superfamily
Class CFCCD27 Class 840
External ID ZINC20609759 External Source ZINC
PubChem CID 6571229 Functional Category Natural Product
Molecule Name (S)-3-(11b-methyl-1,3-dioxo-5,6-dihydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H,11H,11bH)-yl)-N-(3-morpholinopropyl)benzamide
IUPAC Name
Synonyms MolPort-002-523-608;ZINC20609759;MCULE-3665433173
InChi InChI=1S/C28H31N5O4/c1-28-24-22(21-8-2-3-9-23(21)30-24)10-13-32(28)27(36)33(26(28)35)20-7-4-6-19(18-20)25(34)29-11-5-12-31-14-16-37-17-15-31/h2-4,6-9,18,30H,5,10-17H2,1H3,(H,29,34)/t28-/m0/s1
InChiKey GCBDGRYHGSMTIE-NDEPHWFRSA-N
Formula C28H31N5O4 Molecular Weight 501.58
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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