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

1094967 - Overview - Compound Synopsis

Synonyms
1HL
Molecular Formula
C19H15F4N5O2
InChI
InChI=1S/C19H15F4N5O2/c1-18(7-15(19(21,22)23)30-17(25)28-18)12-6-11(3-4-13(12)20)27-16(29)14-5-2-10(8-24)9-26-14/h2-6,9,15H,7H2,1H3,(H2,25,28)(H,27,29)/t15-,18-/m0/s1
Smiles
C[C@@]1(c2cc(NC(=O)c3ccc(C#N)cn3)ccc2F)C[C@@H](C(F)(F)F)OC(N)=N1
Cross References
UniChem32024364
canSAR1094967
PDBe (Protein Data Bank Europe)1HL
ChEMBLCHEMBL2347208
BindingDB50432601
Commercially Available
Unknown


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 421.11618763.225783745Yes


Compounds with the same scaffold


Image of compound ID: 1094967
Murko Scaffold Family: 192 compoundsClick here to open a new canSAR search with these compounds

Maximum number shown here is 12