Compound Synopsis
Compound Overview
Bioactivity Data Summary
Protein Affinity Profile
Cellline Sensitivity Profile

748846 - Overview - Compound Synopsis

Synonyms
C3A
Molecular Formula
C31H35N5O5
InChI
InChI=1S/C31H35N5O5/c1-2-15-40-31(39)34-26(12-9-21-13-14-32-19-21)28(37)29-35-27(41-36-29)16-20-7-10-22(11-8-20)30(38)33-25-17-23-5-3-4-6-24(23)18-25/h2-8,10-11,21,25-26,32H,1,9,12-19H2,(H,33,38)(H,34,39)/t21-,26-/m1/s1
Smiles
C=CCOC(=O)N[C@H](CC[C@@H]1CCNC1)C(=O)c1noc(Cc2ccc(C(=O)NC3Cc4ccccc4C3)cc2)n1
Cross References
UniChem642783
canSAR748846
PDBe (Protein Data Bank Europe)C3A
ChEMBLCHEMBL1231590
Commercially Available
Unknown


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 557.263819223.410831076No


Compounds with the same scaffold


Image of compound ID: 748846
Murko Scaffold Family: 6395 compoundsClick here to open a new canSAR search with these compounds

Maximum number shown here is 12