TCMDC-125383
FEATURES
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NAMES
  • TCMDC-125383
SMILES
C=CCOc1ccc(C2C(C(=O)OC)=C(C)NC3=C2C(=O)c2ccccc23)cc1OC
InChI
InChI=1S/C25H23NO5/c1-5-12-31-18-11-10-15(13-19(18)29-3)21-20(25(28)30-4)14(2)26-23-16-8-6-7-9-17(16)24(27)22(21)23/h5-11,13,21,26H,1,12H2,2-4H3
MOLECULAR FORMULA
C25H23NO5
CROSS REFERENCES
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TCMDC-125383
Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight417.16
AlogP4.00
HBond donors1
HBond acceptors6
Atoms54
Contains toxicophoreNo
Contains PAINSYes
Commercially availableYes
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by TCMDC-125383.