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canSAR1722624
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NAMES
    SMILES
    CCN(CC)CCN1CCn2c3c(c4cc(C)ccc42)CCCC31.Cl
    InChI
    InChI=1S/C21H31N3.ClH/c1-4-22(5-2)11-12-23-13-14-24-19-10-9-16(3)15-18(19)17-7-6-8-20(23)21(17)24;/h9-10,15,20H,4-8,11-14H2,1-3H3;1H
    MOLECULAR FORMULA
    C21H32ClN3
    CROSS REFERENCES
    1722624 logo

    canSAR1722624

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 361.23
    AlogP 4.41
    HBond donors 0
    HBond acceptors 3
    Atoms 57
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1722624.