canSAR1585093
FEATURES
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NAMES
    SMILES
    CO[C@]1(C)CC[C@H](CC(=O)N[C@H]2CC[C@H](CCN3CCC(c4noc5cc(Cl)ccc45)CC3)CC2)CC1
    InChI
    InChI=1S/C30H44ClN3O3/c1-30(36-2)14-9-22(10-15-30)19-28(35)32-25-6-3-21(4-7-25)11-16-34-17-12-23(13-18-34)29-26-8-5-24(31)20-27(26)37-33-29/h5,8,20-23,25H,3-4,6-7,9-19H2,1-2H3,(H,32,35)/t21-,22-,25-,30+
    MOLECULAR FORMULA
    C30H44ClN3O3
    CROSS REFERENCES
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    canSAR1585093
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight529.31
    AlogP6.71
    HBond donors1
    HBond acceptors6
    Atoms81
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1585093.