1131775 logo
canSAR1131775
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=C(CSc1ccc(Br)cc1)Nc1c(C(=O)O)oc2ccccc12
    InChI
    InChI=1S/C17H12BrNO4S/c18-10-5-7-11(8-6-10)24-9-14(20)19-15-12-3-1-2-4-13(12)23-16(15)17(21)22/h1-8H,9H2,(H,19,20)(H,21,22)
    MOLECULAR FORMULA
    C17H12BrNO4S
    CROSS REFERENCES
    1131775 logo

    canSAR1131775

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 404.97
    AlogP 4.62
    HBond donors 2
    HBond acceptors 5
    Atoms 36
    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 canSAR1131775.