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canSAR830326
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NAMES
    SMILES
    Cc1cccc(-c2ccc3c(c2)C(N2CCN(C)CC2)Cc2ccccc2S3)c1C
    InChI
    InChI=1S/C27H30N2S/c1-19-7-6-9-23(20(19)2)21-11-12-27-24(17-21)25(29-15-13-28(3)14-16-29)18-22-8-4-5-10-26(22)30-27/h4-12,17,25H,13-16,18H2,1-3H3
    MOLECULAR FORMULA
    C27H30N2S
    CROSS REFERENCES
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    canSAR830326

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 414.21
    AlogP 5.97
    HBond donors 0
    HBond acceptors 2
    Atoms 60
    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 canSAR830326.