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canSAR2016748
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NAMES
    SMILES
    Cc1ccc(-c2csc3ncnc(N4CCN(C(=O)c5ccccc5)CC4)c23)cc1
    InChI
    InChI=1S/C24H22N4OS/c1-17-7-9-18(10-8-17)20-15-30-23-21(20)22(25-16-26-23)27-11-13-28(14-12-27)24(29)19-5-3-2-4-6-19/h2-10,15-16H,11-14H2,1H3
    MOLECULAR FORMULA
    C24H22N4OS
    CROSS REFERENCES
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    canSAR2016748

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 414.15
    AlogP 4.63
    HBond donors 0
    HBond acceptors 5
    Atoms 52
    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 canSAR2016748.