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canSAR1491519
FEATURES
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NAMES
    SMILES
    CCOC(=O)c1c(NC(=O)CN2C(=O)NC3(CCC(CC)CC3)C2=O)sc(C)c1-c1ccc(C)cc1
    InChI
    InChI=1S/C27H33N3O5S/c1-5-18-11-13-27(14-12-18)25(33)30(26(34)29-27)15-20(31)28-23-22(24(32)35-6-2)21(17(4)36-23)19-9-7-16(3)8-10-19/h7-10,18H,5-6,11-15H2,1-4H3,(H,28,31)(H,29,34)
    MOLECULAR FORMULA
    C27H33N3O5S
    CROSS REFERENCES
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    canSAR1491519

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 511.21
    AlogP 5.04
    HBond donors 2
    HBond acceptors 8
    Atoms 69
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1491519.