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canSAR1646710
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NAMES
    SMILES
    CCCCC(=O)Nc1cc(-c2nc3cccnc3s2)ccc1C
    InChI
    InChI=1S/C18H19N3OS/c1-3-4-7-16(22)20-15-11-13(9-8-12(15)2)17-21-14-6-5-10-19-18(14)23-17/h5-6,8-11H,3-4,7H2,1-2H3,(H,20,22)
    MOLECULAR FORMULA
    C18H19N3OS
    CROSS REFERENCES
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    canSAR1646710

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 325.12
    AlogP 4.80
    HBond donors 1
    HBond acceptors 4
    Atoms 42
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1646710.