CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00399294" 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 CFAMM00399294
Family CFFBM10061 NS3 inhibitor Proline-Based Macrocycle 24 family
Superfamily CFSBM5041 Pol polyprotein and NS3 Binder Superfamily
Class CFCAD590 Class 590
External ID CHEMBL372593 External Source CHEMBL
PubChem CID 44406947 Functional Category Bioactive
Molecule Name CHEMBL372593
InChi InChI=1S/C48H63N7O9S/c1-4-16-39(45(58)47(60)49-30-43(57)50-40(32-53(2)3)34-18-8-5-9-19-34)51-46(59)41-29-36-31-54(41)48(61)44(35-20-10-6-11-21-35)52-42(56)28-33-17-14-22-37(27-33)64-26-15-25-55(36)65(62,63)38-23-12-7-13-24-38/h5,7-9,12-14,17-19,22-24,27,35-36,39-41,44H,4,6,10-11,15-16,20-21,25-26,28-32H2,1-3H3,(H,49,60)(H,50,57)(H,51,59)(H,52,56)/t36-,39?,40-,41+,44+/m1/s1
Formula C48H63N7O9S Molecular Weight 914.12
Cross Link CHEMBL372593

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).

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National University of Singapore, Singapore

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