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

1103684 - Overview - Compound Synopsis

Synonyms
I31
Molecular Formula
C29H32Cl2N2O
InChI
InChI=1S/C29H32Cl2N2O/c1-7-34-25-18-21(27(2,3)4)12-17-24(25)26-32-28(5,19-8-13-22(30)14-9-19)29(6,33-26)20-10-15-23(31)16-11-20/h8-18H,7H2,1-6H3,(H,32,33)/t28-,29+
Smiles
CCOc1cc(C(C)(C)C)ccc1C1=N[C@@](C)(c2ccc(Cl)cc2)[C@@](C)(c2ccc(Cl)cc2)N1
Cross References
UniChem28304004
canSAR1103684
PDBe (Protein Data Bank Europe)I31
ChEMBLCHEMBL2407612
Commercially Available
Unknown


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 494.1891690047.87021366No


Compounds with the same scaffold


Image of compound ID: 1103684
Murko Scaffold Family: 597 compoundsClick here to open a new canSAR search with these compounds

Maximum number shown here is 12