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canSAR78595
FEATURES
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NAMES
    SMILES
    Cc1ccc2c(c1)[C@@H](c1ccccc1)C[C@@H](NC(=O)Nc1cccc(Cl)c1)C(=O)N2CC(=O)NC(C)(C)C
    InChI
    InChI=1S/C30H33ClN4O3/c1-19-13-14-26-24(15-19)23(20-9-6-5-7-10-20)17-25(28(37)35(26)18-27(36)34-30(2,3)4)33-29(38)32-22-12-8-11-21(31)16-22/h5-16,23,25H,17-18H2,1-4H3,(H,34,36)(H2,32,33,38)/t23-,25-/m1/s1
    MOLECULAR FORMULA
    C30H33ClN4O3
    CROSS REFERENCES
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    canSAR78595

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 532.22
    AlogP 5.62
    HBond donors 3
    HBond acceptors 7
    Atoms 71
    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 canSAR78595.