782740 logo
TCMDC-125635
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
  • TCMDC-125635
SMILES
CCCCOC(=O)C1=C(C)NC2=C(C(=O)CC(c3ccc(OC)c(OC)c3)C2)C1c1ccc(O)cc1
InChI
InChI=1S/C29H33NO6/c1-5-6-13-36-29(33)26-17(2)30-22-14-20(19-9-12-24(34-3)25(16-19)35-4)15-23(32)28(22)27(26)18-7-10-21(31)11-8-18/h7-12,16,20,27,30-31H,5-6,13-15H2,1-4H3
MOLECULAR FORMULA
C29H33NO6
CROSS REFERENCES
782740 logo

TCMDC-125635

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 491.23
AlogP 5.11
HBond donors 2
HBond acceptors 7
Atoms 69
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 TCMDC-125635.