2-Demethylthiocolchicine
FEATURES
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NAMES
  • 2-Demethylthiocolchicine
SMILES
COc1cc2c(c(OC)c1O)-c1ccc(SC)c(=O)cc1[C@@H](NC(C)=O)CC2
InChI
InChI=1S/C21H23NO5S/c1-11(23)22-15-7-5-12-9-17(26-2)20(25)21(27-3)19(12)13-6-8-18(28-4)16(24)10-14(13)15/h6,8-10,15,25H,5,7H2,1-4H3,(H,22,23)/t15-/m0/s1
MOLECULAR FORMULA
C21H23NO5S
CROSS REFERENCES
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2-Demethylthiocolchicine
Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight401.13
AlogP3.28
HBond donors2
HBond acceptors6
Atoms51
Contains toxicophoreNo
Contains PAINSNo
Commercially availableYes
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by 2-Demethylthiocolchicine.