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canSAR777158
FEATURES
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NAMES
    SMILES
    COc1ccccc1NC(=O)N(CCCN1[C@H]2CC[C@@H]1C[C@H](n1c(C)nnc1C(C)C)C2)c1ccccc1
    InChI
    InChI=1S/C30H40N6O2/c1-21(2)29-33-32-22(3)36(29)26-19-24-15-16-25(20-26)34(24)17-10-18-35(23-11-6-5-7-12-23)30(37)31-27-13-8-9-14-28(27)38-4/h5-9,11-14,21,24-26H,10,15-20H2,1-4H3,(H,31,37)/t24-,25+,26+
    MOLECULAR FORMULA
    C30H40N6O2
    CROSS REFERENCES
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    canSAR777158

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 516.32
    AlogP 6.02
    HBond donors 1
    HBond acceptors 8
    Atoms 78
    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 canSAR777158.