canSAR857678
FEATURES
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NAMES
    SMILES
    COc1ccc([C@H]2C[C@H]3CC[C@H]([C@H]2C(=O)OC2CCC2)N3C)cc1.Cl
    InChI
    InChI=1S/C20H27NO3.ClH/c1-21-14-8-11-18(21)19(20(22)24-16-4-3-5-16)17(12-14)13-6-9-15(23-2)10-7-13;/h6-7,9-10,14,16-19H,3-5,8,11-12H2,1-2H3;1H/t14-,17-,18-,19+;/m1./s1
    MOLECULAR FORMULA
    C20H28ClNO3
    CROSS REFERENCES
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    canSAR857678
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight365.18
    AlogP3.78
    HBond donors0
    HBond acceptors4
    Atoms53
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR857678.