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canSAR1517190
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NAMES
    SMILES
    O=C(N[C@H]1CC[C@H](CCN2CCc3ccc(Cl)cc3C2)CC1)c1cc2ccccc2[nH]1
    InChI
    InChI=1S/C26H30ClN3O/c27-22-8-7-19-12-14-30(17-21(19)15-22)13-11-18-5-9-23(10-6-18)28-26(31)25-16-20-3-1-2-4-24(20)29-25/h1-4,7-8,15-16,18,23,29H,5-6,9-14,17H2,(H,28,31)/t18-,23-
    MOLECULAR FORMULA
    C26H30ClN3O
    CROSS REFERENCES
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    canSAR1517190

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 435.21
    AlogP 5.56
    HBond donors 2
    HBond acceptors 4
    Atoms 61
    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 canSAR1517190.