TCMDC-133058
FEATURES
Loading...
NAMES
  • TCMDC-133058
SMILES
Cc1noc(C)c1-c1cccc(CNCc2ccc(-c3ccc(-c4nc5cc(C(F)(F)F)ccc5[nH]4)cc3)cc2)c1.O=C(O)C(F)(F)F
InChI
InChI=1S/C33H27F3N4O.C2HF3O2/c1-20-31(21(2)41-40-20)27-5-3-4-23(16-27)19-37-18-22-6-8-24(9-7-22)25-10-12-26(13-11-25)32-38-29-15-14-28(33(34,35)36)17-30(29)39-32;3-2(4,5)1(6)7/h3-17,37H,18-19H2,1-2H3,(H,38,39);(H,6,7)
MOLECULAR FORMULA
C35H28F6N4O3
CROSS REFERENCES
Loading...
TCMDC-133058
Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight666.21
AlogP9.11
HBond donors3
HBond acceptors7
Atoms76
Contains toxicophoreYes
Contains PAINSNo
Commercially availableUnknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by TCMDC-133058.