1017089 logo
3QI
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
  • 3QI
SMILES
Cc1ccnc(-n2c(S)nc3sc(C)c(C)c3c2=O)c1
InChI
InChI=1S/C14H13N3OS2/c1-7-4-5-15-10(6-7)17-13(18)11-8(2)9(3)20-12(11)16-14(17)19/h4-6H,1-3H3,(H,16,19)
MOLECULAR FORMULA
C14H13N3OS2
CROSS REFERENCES
  • UniChem: 4498362
  • canSAR: 1017089
  • PDBe (Protein Data Bank Europe): 3QI
1017089 logo

3QI

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 303.05
AlogP 3.06
HBond donors 0
HBond acceptors 4
Atoms 33
Contains toxicophore No
Contains PAINS No
Commercially available Yes
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by 3QI.