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canSAR1434650
FEATURES
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NAMES
    SMILES
    COc1ccc(F)cc1-c1ccnc2[nH]c([C@@H]3CCCNC3)cc12
    InChI
    InChI=1S/C19H20FN3O/c1-24-18-5-4-13(20)9-15(18)14-6-8-22-19-16(14)10-17(23-19)12-3-2-7-21-11-12/h4-6,8-10,12,21H,2-3,7,11H2,1H3,(H,22,23)/t12-/m1/s1
    MOLECULAR FORMULA
    C19H20FN3O
    CROSS REFERENCES
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    canSAR1434650

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 325.16
    AlogP 3.84
    HBond donors 2
    HBond acceptors 4
    Atoms 44
    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 canSAR1434650.