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

1016999 - Overview - Compound Synopsis

Synonyms
0MP
Molecular Formula
C28H38FN3O3
InChI
InChI=1S/C28H38FN3O3/c1-18(33)32-23(13-19-6-8-21(29)9-7-19)25(34)17-30-24-15-28(10-5-11-28)35-26-22(24)12-20(16-31-26)14-27(2,3)4/h6-9,12,16,23-25,30,34H,5,10-11,13-15,17H2,1-4H3,(H,32,33)/t23-,24-,25+/m0/s1
Smiles
CC(=O)N[C@@H](Cc1ccc(F)cc1)[C@H](O)CN[C@H]1CC2(CCC2)Oc2ncc(CC(C)(C)C)cc21
Cross References
UniChem27265683
canSAR1016999
PDBe (Protein Data Bank Europe)0MP
ChEMBLCHEMBL2030997
BindingDB50383839
Commercially Available
Unknown


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 483.2897202964.25353673No


Compounds with the same scaffold


Image of compound ID: 1016999
Murko Scaffold Family: 1 compoundsClick here to open a new canSAR search with these compounds

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