CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00308865" 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 CFAMM00308865
Family CFFBM204 Pol polyprotein and Protease inhibitor 161186-52-3 family
Superfamily CFSBM124 Protease and Pol polyprotein Binder Superfamily
Class CFCCD63 Class 876
External ID CHEMBL321298 External Source CHEMBL
PubChem CID 460236 Functional Category Bioactive
Molecule Name Statine deriv. 45
IUPAC Name 1H-benzimidazol-2-ylmethyl (2S)-2-[[(2R,3R,4S)-2-(benzylamino)-3-hydroxy-4-[[(2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-5-phenylpentanoyl]amino]-3-methylbutanoate
Synonyms AC1LA203;(2R,3R,4S)-N-[2-(Benzylamino)-4-[[N-[(benzyloxy)carbonyl]valyl]amino]-3-hydroxy-5- phenylpentanoyl]valine (2-benzimidazolyl)methyl ester;1H-benzimidazol-2-ylmethyl (2S)-2-[[(2R,3R,4S)-2-(benzylamino)-3-hydroxy-4-[[(2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-5-phenylpentanoyl]amino]-3-methylbutanoate
InChi InChI=1S/C44H52N6O7/c1-28(2)37(50-44(55)57-26-32-20-12-7-13-21-32)41(52)48-35(24-30-16-8-5-9-17-30)40(51)39(45-25-31-18-10-6-11-19-31)42(53)49-38(29(3)4)43(54)56-27-36-46-33-22-14-15-23-34(33)47-36/h5-23,28-29,35,37-40,45,51H,24-27H2,1-4H3,(H,46,47)(H,48,52)(H,49,53)(H,50,55)/t35-,37-,38-,39+,40+/m0/s1
Formula C44H52N6O7 Molecular Weight 776.92
Cross Link CHEMBL321298

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



109178 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', 'CFAMM00308865'),None, txtsearch, CFAMM00308865|