CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00257689" 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 CFAMM00257689
Family CFFID2034 Proto-oncogene tyrosine-protein kinase Src Inhibitor Ac-cys-ile-tyr-lys-phe(4-i)-tyr Family
Superfamily CFSID1525 Proto-oncogene tyrosine-protein kinase Src Inhibitor Ac-cys-ile-tyr-lys-phe(4-i)-tyr Superfamily
Class CFCID978 Class 2328
External ID CHEMBL170091 External Source CHEMBL
PubChem CID 44382892 Functional Category Bioactive
Molecule Name (2R)-N-[(2S)-1-[[(2S)-1-[[2-(1-adamantylamino)-2-oxoethyl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxopropan-2-yl]-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-4-methylsulfanylbutanamide
IUPAC Name (2R)-N-[(2S)-1-[[(2S)-1-[[2-(1-adamantylamino)-2-oxoethyl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxopropan-2-yl]-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-4-methylsulfanylbutanamide
Synonyms CHEBI:385823
InChi InChI=1S/C38H52N6O6S/c1-23(41-37(50)31(12-13-51-2)42-35(48)30(39)17-25-8-10-29(45)11-9-25)34(47)43-32(18-24-6-4-3-5-7-24)36(49)40-22-33(46)44-38-19-26-14-27(20-38)16-28(15-26)21-38/h3-11,23,26-28,30-32,45H,12-22,39H2,1-2H3,(H,40,49)(H,41,50)(H,42,48)(H,43,47)(H,44,46)/t23-,26?,27?,28?,30-,31+,32-,38?/m0/s1
Formula C38H52N6O6S Molecular Weight 720.92
Cross Link CHEMBL170091

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



67688 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', 'CFAMM00257689'),None, txtsearch, CFAMM00257689|