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canSAR1719916
FEATURES
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NAMES
    SMILES
    O=C(CC1COCCO1)N[C@H]1CC[C@H](CCN2CCC(c3coc4ccccc34)CC2)CC1
    InChI
    InChI=1S/C27H38N2O4/c30-27(17-23-18-31-15-16-32-23)28-22-7-5-20(6-8-22)9-12-29-13-10-21(11-14-29)25-19-33-26-4-2-1-3-24(25)26/h1-4,19-23H,5-18H2,(H,28,30)/t20-,22-,23?
    MOLECULAR FORMULA
    C27H38N2O4
    CROSS REFERENCES
    1719916 logo

    canSAR1719916

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 454.28
    AlogP 4.48
    HBond donors 1
    HBond acceptors 6
    Atoms 71
    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 canSAR1719916.