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canSAR114698
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NAMES
    SMILES
    CCN(CC)c1ccncc1-c1c(Cl)ncn1-c1ccc(S(C)(=O)=O)cc1
    InChI
    InChI=1S/C19H21ClN4O2S/c1-4-23(5-2)17-10-11-21-12-16(17)18-19(20)22-13-24(18)14-6-8-15(9-7-14)27(3,25)26/h6-13H,4-5H2,1-3H3
    MOLECULAR FORMULA
    C19H21ClN4O2S
    CROSS REFERENCES
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    canSAR114698

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 404.11
    AlogP 3.84
    HBond donors 0
    HBond acceptors 6
    Atoms 48
    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 canSAR114698.