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canSAR1974145
FEATURES
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NAMES
    SMILES
    O=C(C1CCCN(Cc2ccncc2)C1)N1CCc2ccccc2C1.O=C(O)C(=O)O
    InChI
    InChI=1S/C21H25N3O.C2H2O4/c25-21(24-13-9-18-4-1-2-5-19(18)16-24)20-6-3-12-23(15-20)14-17-7-10-22-11-8-17;3-1(4)2(5)6/h1-2,4-5,7-8,10-11,20H,3,6,9,12-16H2;(H,3,4)(H,5,6)
    MOLECULAR FORMULA
    C23H27N3O5
    CROSS REFERENCES
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    canSAR1974145

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 425.20
    AlogP 2.03
    HBond donors 2
    HBond acceptors 8
    Atoms 58
    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 canSAR1974145.