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TCMDC-125656
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NAMES
  • TCMDC-125656
SMILES
CCOC(=O)c1ccc(N=C2SC(=Cc3cc(Br)ccc3O)C(=O)N2C)cc1
InChI
InChI=1S/C20H17BrN2O4S/c1-3-27-19(26)12-4-7-15(8-5-12)22-20-23(2)18(25)17(28-20)11-13-10-14(21)6-9-16(13)24/h4-11,24H,3H2,1-2H3
MOLECULAR FORMULA
C20H17BrN2O4S
CROSS REFERENCES
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TCMDC-125656

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 460.01
AlogP 4.57
HBond donors 1
HBond acceptors 6
Atoms 45
Contains toxicophore Yes
Contains PAINS No
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by TCMDC-125656.