TCMDC-140592
FEATURES
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NAMES
  • TCMDC-140592
SMILES
CC(C)CNCc1cccc(-c2cccc(CN(CCN(C)C)C(=O)Nc3ccccc3)c2)c1.O=C(O)C(F)(F)F
InChI
InChI=1S/C29H38N4O.C2HF3O2/c1-23(2)20-30-21-24-10-8-12-26(18-24)27-13-9-11-25(19-27)22-33(17-16-32(3)4)29(34)31-28-14-6-5-7-15-28;3-2(4,5)1(6)7/h5-15,18-19,23,30H,16-17,20-22H2,1-4H3,(H,31,34);(H,6,7)
MOLECULAR FORMULA
C31H39F3N4O3
CROSS REFERENCES
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TCMDC-140592
Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight572.30
AlogP6.33
HBond donors3
HBond acceptors7
Atoms80
Contains toxicophoreYes
Contains PAINSNo
Commercially availableUnknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by TCMDC-140592.