558336 logo
canSAR558336
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    Cc1cccnc1Nc1nc2ccc(C(=N)NC(C)C)cc2s1
    InChI
    InChI=1S/C17H19N5S/c1-10(2)20-15(18)12-6-7-13-14(9-12)23-17(21-13)22-16-11(3)5-4-8-19-16/h4-10H,1-3H3,(H2,18,20)(H,19,21,22)
    MOLECULAR FORMULA
    C17H19N5S
    CROSS REFERENCES
    558336 logo

    canSAR558336

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 325.14
    AlogP 4.07
    HBond donors 3
    HBond acceptors 5
    Atoms 42
    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 canSAR558336.