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

1004405 - Overview - Compound Synopsis

Synonyms
Molecular Formula
C22H24FN5O2S
InChI
InChI=1S/C22H24FN5O2S/c1-2-3-4-5-9-17-26-20(24-11-14-7-6-8-15(23)10-14)18-21(27-17)28(13-25-18)22-19(30)16(29)12-31-22/h6-8,10,13,16,19,22,29-30H,2-4,11-12H2,1H3,(H,24,26,27)/t16-,19-,22-/m1/s1
Smiles
CCCCC#Cc1nc(NCc2cccc(F)c2)c2ncn([C@@H]3SC[C@@H](O)[C@H]3O)c2n1
Cross References
UniChem27216641
canSAR1004405
ChEMBLCHEMBL1946294
BindingDB50363180
Commercially Available
Unknown


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 441.1634742283.08643755No