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canSAR787904
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NAMES
    SMILES
    CCn1cc(-c2ccccc2)c2c1[C@@H]1Oc3c(O)ccc4c3[C@@]13CCN(CC1CC1)C(C4)[C@]3(O)C2
    InChI
    InChI=1S/C30H32N2O3/c1-2-31-17-22(19-6-4-3-5-7-19)21-15-30(34)24-14-20-10-11-23(33)27-25(20)29(30,28(35-27)26(21)31)12-13-32(24)16-18-8-9-18/h3-7,10-11,17-18,24,28,33-34H,2,8-9,12-16H2,1H3/t24?,28-,29-,30+/m0/s1
    MOLECULAR FORMULA
    C30H32N2O3
    CROSS REFERENCES
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    canSAR787904

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 468.24
    AlogP 4.58
    HBond donors 2
    HBond acceptors 5
    Atoms 67
    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 canSAR787904.