TCMDC-141551
FEATURES
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NAMES
  • TCMDC-141551
SMILES
CCCNCc1ccc(-c2ccc(CN(C(=O)c3nn(-c4ccccc4)nc3C)C(C)CN(C)C)cc2)nc1.O=C(O)C(F)(F)F
InChI
InChI=1S/C31H39N7O.C2HF3O2/c1-6-18-32-19-26-14-17-29(33-20-26)27-15-12-25(13-16-27)22-37(23(2)21-36(4)5)31(39)30-24(3)34-38(35-30)28-10-8-7-9-11-28;3-2(4,5)1(6)7/h7-17,20,23,32H,6,18-19,21-22H2,1-5H3;(H,6,7)
MOLECULAR FORMULA
C33H40F3N7O3
CROSS REFERENCES
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TCMDC-141551
Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight639.31
AlogP5.36
HBond donors2
HBond acceptors10
Atoms86
Contains toxicophoreYes
Contains PAINSNo
Commercially availableUnknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by TCMDC-141551.