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TCMDC-141203
FEATURES
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NAMES
  • TCMDC-141203
SMILES
O=C(O)C(F)(F)F.O=[N+]([O-])c1cccc(CNC2CCN(Cc3ccc(-c4ccccc4)cc3)CC2)c1
InChI
InChI=1S/C25H27N3O2.C2HF3O2/c29-28(30)25-8-4-5-21(17-25)18-26-24-13-15-27(16-14-24)19-20-9-11-23(12-10-20)22-6-2-1-3-7-22;3-2(4,5)1(6)7/h1-12,17,24,26H,13-16,18-19H2;(H,6,7)
MOLECULAR FORMULA
C27H28F3N3O4
CROSS REFERENCES
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TCMDC-141203

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 515.20
AlogP 5.65
HBond donors 2
HBond acceptors 7
Atoms 65
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-141203.