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canSAR781748
FEATURES
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NAMES
    SMILES
    C[C@]12CC=C3C4=C(CCC3[C@@H]1CCC2=O)NCCC4=O.C[C@]12CCC3=C(CCC4=C3C(=O)CCN4)[C@@H]1CCC2=O
    InChI
    InChI=1S/2C17H21NO2/c2*1-17-8-6-11-10(12(17)3-5-15(17)20)2-4-13-16(11)14(19)7-9-18-13/h12,18H,2-9H2,1H3;6,10,12,18H,2-5,7-9H2,1H3/t12-,17-;10?,12-,17-/m00/s1
    MOLECULAR FORMULA
    C34H42N2O4
    CROSS REFERENCES
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    canSAR781748

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 542.31
    AlogP 5.20
    HBond donors 2
    HBond acceptors 6
    Atoms 82
    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 canSAR781748.