1999988 logo
canSAR1999988
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCc1[nH]cc2c1NC1=C(C(=O)CCC1)C2c1cccc(Sc2nc3ccccc3[nH]2)c1
    InChI
    InChI=1S/C26H24N4OS/c1-2-18-25-17(14-27-18)23(24-21(28-25)11-6-12-22(24)31)15-7-5-8-16(13-15)32-26-29-19-9-3-4-10-20(19)30-26/h3-5,7-10,13-14,23,27-28H,2,6,11-12H2,1H3,(H,29,30)
    MOLECULAR FORMULA
    C26H24N4OS
    CROSS REFERENCES
    1999988 logo

    canSAR1999988

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 440.17
    AlogP 6.17
    HBond donors 3
    HBond acceptors 5
    Atoms 56
    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 canSAR1999988.