785918 logo
canSAR785918
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=C1CSC(c2ccccc2)N1n1c(CSc2nnc(-c3ccncc3)o2)nc2ccc(Br)cc2c1=O
    InChI
    InChI=1S/C25H17BrN6O3S2/c26-17-6-7-19-18(12-17)23(34)31(32-21(33)14-36-24(32)16-4-2-1-3-5-16)20(28-19)13-37-25-30-29-22(35-25)15-8-10-27-11-9-15/h1-12,24H,13-14H2
    MOLECULAR FORMULA
    C25H17BrN6O3S2
    CROSS REFERENCES
    785918 logo

    canSAR785918

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 592.00
    AlogP 4.81
    HBond donors 0
    HBond acceptors 9
    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 canSAR785918.