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canSAR1985607
FEATURES
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NAMES
    SMILES
    CS(=O)(=O)c1ccc(Nc2nn([C@H]3CC[C@H](N4CC5(CCC5)C4)C[C@@H]3C#N)cc2C(N)=O)cc1
    InChI
    InChI=1S/C24H30N6O3S/c1-34(32,33)19-6-3-17(4-7-19)27-23-20(22(26)31)13-30(28-23)21-8-5-18(11-16(21)12-25)29-14-24(15-29)9-2-10-24/h3-4,6-7,13,16,18,21H,2,5,8-11,14-15H2,1H3,(H2,26,31)(H,27,28)/t16-,18+,21+/m1/s1
    MOLECULAR FORMULA
    C24H30N6O3S
    CROSS REFERENCES
    1985607 logo

    canSAR1985607

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 482.21
    AlogP 2.85
    HBond donors 3
    HBond acceptors 9
    Atoms 64
    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 canSAR1985607.