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TCMDC-133910
FEATURES
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NAMES
  • TCMDC-133910
SMILES
Fc1ccc2[nH]c(-c3ccc(-c4ccc(CN5CCCCC5)cc4)cc3)nc2c1.O=C(O)C(F)(F)F
InChI
InChI=1S/C25H24FN3.C2HF3O2/c26-22-12-13-23-24(16-22)28-25(27-23)21-10-8-20(9-11-21)19-6-4-18(5-7-19)17-29-14-2-1-3-15-29;3-2(4,5)1(6)7/h4-13,16H,1-3,14-15,17H2,(H,27,28);(H,6,7)
MOLECULAR FORMULA
C27H25F4N3O2
CROSS REFERENCES
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TCMDC-133910

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 499.19
AlogP 6.66
HBond donors 2
HBond acceptors 5
Atoms 61
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-133910.