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

1017339 - Overview - Compound Synopsis

Synonyms
CI3
Molecular Formula
C23H24ClNO4
InChI
InChI=1S/C23H24ClNO4/c24-19-9-7-17(8-10-19)14-23(21(27)13-20(26)22(28)29)11-4-12-25(16-23)15-18-5-2-1-3-6-18/h1-3,5-10,13,26H,4,11-12,14-16H2,(H,28,29)/b20-13-/t23-/m0/s1
Smiles
O=C(O)/C(O)=C/C(=O)[C@]1(Cc2ccc(Cl)cc2)CCCN(Cc2ccccc2)C1
Cross References
UniChem61978393
canSAR1017339
PDBe (Protein Data Bank Europe)CI3
Commercially Available
Unknown


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 413.1393859284.26052553Yes


Compounds with the same scaffold


Image of compound ID: 1017339
Murko Scaffold Family: 230 compoundsClick here to open a new canSAR search with these compounds

Maximum number shown here is 12