canSAR1808844
FEATURES
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NAMES
    SMILES
    O=C1NC[C@H](Cc2ccccc2)N(CC2CCN(CCC34CC5CC(CC(C5)C3)C4)CC2)C1=O
    InChI
    InChI=1S/C29H41N3O2/c33-27-28(34)32(26(19-30-27)15-21-4-2-1-3-5-21)20-22-6-9-31(10-7-22)11-8-29-16-23-12-24(17-29)14-25(13-23)18-29/h1-5,22-26H,6-20H2,(H,30,33)/t23?,24?,25?,26-,29?/m0/s1
    MOLECULAR FORMULA
    C29H41N3O2
    CROSS REFERENCES
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    canSAR1808844
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight463.32
    AlogP3.87
    HBond donors1
    HBond acceptors5
    Atoms75
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1808844.