1127940 logo
canSAR1127940
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COc1cc2nc(Sc3cc([N+](=O)[O-])ccc3C(=O)O)n(Cc3ccccc3)c(=O)c2cc1OC
    InChI
    InChI=1S/C24H19N3O7S/c1-33-19-11-17-18(12-20(19)34-2)25-24(26(22(17)28)13-14-6-4-3-5-7-14)35-21-10-15(27(31)32)8-9-16(21)23(29)30/h3-12H,13H2,1-2H3,(H,29,30)
    MOLECULAR FORMULA
    C24H19N3O7S
    CROSS REFERENCES
    1127940 logo

    canSAR1127940

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 493.09
    AlogP 4.22
    HBond donors 1
    HBond acceptors 10
    Atoms 54
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1127940.