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TCMDC-136427
FEATURES
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NAMES
  • TCMDC-136427
SMILES
Cc1ccc(NC(=O)c2ccc(CN3CCCN(Cc4cccc(O)c4)CC3)cc2)cc1C.O=C(O)C(F)(F)F
InChI
InChI=1S/C28H33N3O2.C2HF3O2/c1-21-7-12-26(17-22(21)2)29-28(33)25-10-8-23(9-11-25)19-30-13-4-14-31(16-15-30)20-24-5-3-6-27(32)18-24;3-2(4,5)1(6)7/h3,5-12,17-18,32H,4,13-16,19-20H2,1-2H3,(H,29,33);(H,6,7)
MOLECULAR FORMULA
C30H34F3N3O4
CROSS REFERENCES
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TCMDC-136427

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 557.25
AlogP 5.60
HBond donors 3
HBond acceptors 7
Atoms 74
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-136427.