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canSAR465581
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NAMES
    SMILES
    CC(C)c1nc2c(c(-c3ccc(F)cc3)n1)CCNCC2
    InChI
    InChI=1S/C17H20FN3/c1-11(2)17-20-15-8-10-19-9-7-14(15)16(21-17)12-3-5-13(18)6-4-12/h3-6,11,19H,7-10H2,1-2H3
    MOLECULAR FORMULA
    C17H20FN3
    CROSS REFERENCES
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    canSAR465581

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 285.16
    AlogP 3.09
    HBond donors 1
    HBond acceptors 3
    Atoms 41
    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 canSAR465581.