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canSAR102605
FEATURES
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NAMES
    SMILES
    CCc1nnc(NC(=O)C2(CC(CCc3ccccc3)C(=O)O)CCCC2)s1
    InChI
    InChI=1S/C21H27N3O3S/c1-2-17-23-24-20(28-17)22-19(27)21(12-6-7-13-21)14-16(18(25)26)11-10-15-8-4-3-5-9-15/h3-5,8-9,16H,2,6-7,10-14H2,1H3,(H,25,26)(H,22,24,27)
    MOLECULAR FORMULA
    C21H27N3O3S
    CROSS REFERENCES
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    canSAR102605

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 401.18
    AlogP 4.32
    HBond donors 2
    HBond acceptors 6
    Atoms 55
    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 canSAR102605.