canSAR86360
FEATURES
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NAMES
    SMILES
    O=C(O)[C@@H]1Cc2c(ncn2CCC23CC4CC(CC(C4)C2)C3)CN1C(=O)C(c1ccccc1)c1ccccc1
    InChI
    InChI=1S/C33H37N3O3/c37-31(30(25-7-3-1-4-8-25)26-9-5-2-6-10-26)36-20-27-28(16-29(36)32(38)39)35(21-34-27)12-11-33-17-22-13-23(18-33)15-24(14-22)19-33/h1-10,21-24,29-30H,11-20H2,(H,38,39)/t22?,23?,24?,29-,33?/m0/s1
    MOLECULAR FORMULA
    C33H37N3O3
    CROSS REFERENCES
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    canSAR86360
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight523.28
    AlogP5.66
    HBond donors1
    HBond acceptors6
    Atoms76
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR86360.