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TCMDC-134485
FEATURES
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NAMES
  • TCMDC-134485
SMILES
O=C(NCC1CCN(Cc2cccc(C(F)(F)F)c2)C1)c1cc(-c2cccc(Cl)c2)cs1.O=C(O)C(F)(F)F
InChI
InChI=1S/C24H22ClF3N2OS.C2HF3O2/c25-21-6-2-4-18(10-21)19-11-22(32-15-19)23(31)29-12-17-7-8-30(14-17)13-16-3-1-5-20(9-16)24(26,27)28;3-2(4,5)1(6)7/h1-6,9-11,15,17H,7-8,12-14H2,(H,29,31);(H,6,7)
MOLECULAR FORMULA
C26H23ClF6N2O3S
CROSS REFERENCES
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TCMDC-134485

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 592.10
AlogP 6.97
HBond donors 2
HBond acceptors 5
Atoms 62
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-134485.