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canSAR3461
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NAMES
    SMILES
    O=C(N[C@H]1CN2CCC1CC2)c1ccc2ccsc2c1
    InChI
    InChI=1S/C16H18N2OS/c19-16(13-2-1-12-5-8-20-15(12)9-13)17-14-10-18-6-3-11(14)4-7-18/h1-2,5,8-9,11,14H,3-4,6-7,10H2,(H,17,19)/t14-/m0/s1
    MOLECULAR FORMULA
    C16H18N2OS
    CROSS REFERENCES
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    canSAR3461

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 286.11
    AlogP 2.73
    HBond donors 1
    HBond acceptors 3
    Atoms 38
    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 canSAR3461.