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TCMDC-123677
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NAMES
  • TCMDC-123677
SMILES
NCCNc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(C(F)(F)F)c1
InChI
InChI=1S/C16H15F3N4O3/c17-16(18,19)10-2-1-3-11(8-10)22-15(24)13-9-12(23(25)26)4-5-14(13)21-7-6-20/h1-5,8-9,21H,6-7,20H2,(H,22,24)
MOLECULAR FORMULA
C16H15F3N4O3
CROSS REFERENCES
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TCMDC-123677

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 368.11
AlogP 3.24
HBond donors 4
HBond acceptors 7
Atoms 41
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-123677.