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canSAR848387
FEATURES
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NAMES
    SMILES
    C[C@@H]1CC[C@H]2[C@@H](C)[C@H](c3ccc(CN4CCCC4)[nH]3)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4
    InChI
    InChI=1S/C24H36N2O4/c1-15-6-8-19-16(2)21(20-9-7-17(25-20)14-26-12-4-5-13-26)27-22-24(19)18(15)10-11-23(3,28-22)29-30-24/h7,9,15-16,18-19,21-22,25H,4-6,8,10-14H2,1-3H3/t15-,16-,18+,19+,21-,22-,23-,24-/m1/s1
    MOLECULAR FORMULA
    C24H36N2O4
    CROSS REFERENCES
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    canSAR848387

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 416.27
    AlogP 4.53
    HBond donors 1
    HBond acceptors 6
    Atoms 66
    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 canSAR848387.