4MS
FEATURES
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NAMES
  • 4MS
SMILES
CC(C)(C)[C@H]1C(O)=C(C2=NS(=O)(=O)c3c(CNS(C)(=O)=O)cccc32)C(=O)N1Cc1ccc(F)c(Cl)c1
InChI
InChI=1S/C24H25ClFN3O6S2/c1-24(2,3)22-20(30)18(23(31)29(22)12-13-8-9-17(26)16(25)10-13)19-15-7-5-6-14(11-27-36(4,32)33)21(15)37(34,35)28-19/h5-10,22,27,30H,11-12H2,1-4H3/t22-/m1/s1
MOLECULAR FORMULA
C24H25ClFN3O6S2
CROSS REFERENCES
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4MS
Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight569.09
AlogP3.29
HBond donors2
HBond acceptors9
Atoms62
Contains toxicophoreNo
Contains PAINSNo
Commercially availableUnknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by 4MS.