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

859814 - Overview - Compound Synopsis

Synonyms
A54
Molecular Formula
C16H15ClN2O
InChI
InChI=1S/C16H15ClN2O/c17-14-7-6-13(11-19)16(10-14)20-15(8-9-18)12-4-2-1-3-5-12/h1-7,10,15H,8-9,18H2/t15-/m1/s1
Smiles
N#Cc1ccc(Cl)cc1O[C@H](CCN)c1ccccc1
Cross References
UniChem1005185
canSAR859814
ChEMBLCHEMBL1738761
PDBe (Protein Data Bank Europe)A54
BindingDB50339997
Commercially Available
Unknown


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 286.087290783.680582335Yes


Compounds with the same scaffold


Image of compound ID: 859814
Murko Scaffold Family: 4119 compoundsClick here to open a new canSAR search with these compounds

Maximum number shown here is 12





Compound Lineages


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