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canSAR1025461
FEATURES
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NAMES
    SMILES
    CC1CCCC1N1CC[C@H](NC(=O)c2ccc3ncsc3c2)C1
    InChI
    InChI=1S/C18H23N3OS/c1-12-3-2-4-16(12)21-8-7-14(10-21)20-18(22)13-5-6-15-17(9-13)23-11-19-15/h5-6,9,11-12,14,16H,2-4,7-8,10H2,1H3,(H,20,22)/t12?,14-,16?/m0/s1
    MOLECULAR FORMULA
    C18H23N3OS
    CROSS REFERENCES
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    canSAR1025461

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 329.16
    AlogP 3.29
    HBond donors 1
    HBond acceptors 4
    Atoms 46
    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 canSAR1025461.