562364 logo
TCMDC-139406
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
  • TCMDC-139406
SMILES
Cl.O=S(=O)(Nc1ccc2nccc(N3CCNCC3)c2c1)c1ccc2oc3ccccc3c2c1
InChI
InChI=1S/C25H22N4O3S.ClH/c30-33(31,18-6-8-25-20(16-18)19-3-1-2-4-24(19)32-25)28-17-5-7-22-21(15-17)23(9-10-27-22)29-13-11-26-12-14-29;/h1-10,15-16,26,28H,11-14H2;1H
MOLECULAR FORMULA
C25H23ClN4O3S
CROSS REFERENCES
562364 logo

TCMDC-139406

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 494.12
AlogP 4.77
HBond donors 2
HBond acceptors 7
Atoms 57
Contains toxicophore No
Contains PAINS No
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by TCMDC-139406.