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

748487 - Overview - Compound Synopsis

Synonyms
73
Molecular Formula
C32H28F2N3O5P
InChI
InChI=1S/C32H28F2N3O5P/c1-42-30(38)25-15-19-26(20-16-25)31(21-7-10-23-8-3-2-4-9-23,37-29-12-6-5-11-28(29)35-36-37)22-24-13-17-27(18-14-24)32(33,34)43(39,40)41/h2-20H,21-22H2,1H3,(H2,39,40,41)/b10-7+/t31-/m1/s1
Smiles
COC(=O)c1ccc([C@@](C/C=C/c2ccccc2)(Cc2ccc(C(F)(F)P(=O)(O)O)cc2)n2nnc3ccccc32)cc1
Cross References
UniChem643579
canSAR748487
PDBe (Protein Data Bank Europe)73
ChEMBLCHEMBL1229530
Commercially Available
Unknown


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 603.1734640666.53472871No


Compounds with the same scaffold


Image of compound ID: 748487
Murko Scaffold Family: 1996 compoundsClick here to open a new canSAR search with these compounds

Maximum number shown here is 12