canSAR1137263
FEATURES
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NAMES
    SMILES
    CCOC(=O)[C@]1(c2ccccc2)N=C(c2ccc(OC)cc2)N(Cc2ccccc2)[C@@H]1c1ccc(NCC2CCCCC2)cc1
    InChI
    InChI=1S/C39H43N3O3/c1-3-45-38(43)39(33-17-11-6-12-18-33)36(31-19-23-34(24-20-31)40-27-29-13-7-4-8-14-29)42(28-30-15-9-5-10-16-30)37(41-39)32-21-25-35(44-2)26-22-32/h5-6,9-12,15-26,29,36,40H,3-4,7-8,13-14,27-28H2,1-2H3/t36-,39-/m1/s1
    MOLECULAR FORMULA
    C39H43N3O3
    CROSS REFERENCES
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    canSAR1137263
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight601.33
    AlogP8.15
    HBond donors1
    HBond acceptors6
    Atoms88
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1137263.