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canSAR1719612
FEATURES
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NAMES
    SMILES
    COc1cccc(N(C(=O)c2sc(C)nc2C)C(C(=O)NCC2CCCO2)c2ccccc2)c1
    InChI
    InChI=1S/C26H29N3O4S/c1-17-24(34-18(2)28-17)26(31)29(20-11-7-12-21(15-20)32-3)23(19-9-5-4-6-10-19)25(30)27-16-22-13-8-14-33-22/h4-7,9-12,15,22-23H,8,13-14,16H2,1-3H3,(H,27,30)
    MOLECULAR FORMULA
    C26H29N3O4S
    CROSS REFERENCES
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    canSAR1719612

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 479.19
    AlogP 4.45
    HBond donors 1
    HBond acceptors 7
    Atoms 63
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1719612.