TCMDC-132294
FEATURES
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NAMES
  • TCMDC-132294
SMILES
COc1ccc(CNCc2ccc(F)cc2)cc1-c1ccc(S(=O)(=O)NCCN2CCCC2)cc1.O=C(O)C(F)(F)F
InChI
InChI=1S/C27H32FN3O3S.C2HF3O2/c1-34-27-13-6-22(20-29-19-21-4-9-24(28)10-5-21)18-26(27)23-7-11-25(12-8-23)35(32,33)30-14-17-31-15-2-3-16-31;3-2(4,5)1(6)7/h4-13,18,29-30H,2-3,14-17,19-20H2,1H3;(H,6,7)
MOLECULAR FORMULA
C29H33F4N3O5S
CROSS REFERENCES
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TCMDC-132294
Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight611.21
AlogP4.80
HBond donors3
HBond acceptors8
Atoms75
Contains toxicophoreYes
Contains PAINSNo
Commercially availableUnknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by TCMDC-132294.