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canSAR1596963
FEATURES
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NAMES
    SMILES
    CC(=O)C1CCC2C3CC=C4CC(SC(=N)N)CCC4(C)C3CCC12C
    InChI
    InChI=1S/C22H34N2OS/c1-13(25)17-6-7-18-16-5-4-14-12-15(26-20(23)24)8-10-21(14,2)19(16)9-11-22(17,18)3/h4,15-19H,5-12H2,1-3H3,(H3,23,24)
    MOLECULAR FORMULA
    C22H34N2OS
    CROSS REFERENCES
    1596963 logo

    canSAR1596963

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 374.24
    AlogP 5.15
    HBond donors 3
    HBond acceptors 3
    Atoms 60
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1596963.