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canSAR1132299
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NAMES
    SMILES
    NC(=O)Nc1sc(-c2ccccc2O[C@@H]2CCNC2)cc1C(N)=O
    InChI
    InChI=1S/C16H18N4O3S/c17-14(21)11-7-13(24-15(11)20-16(18)22)10-3-1-2-4-12(10)23-9-5-6-19-8-9/h1-4,7,9,19H,5-6,8H2,(H2,17,21)(H3,18,20,22)/t9-/m1/s1
    MOLECULAR FORMULA
    C16H18N4O3S
    CROSS REFERENCES
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    canSAR1132299

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 346.11
    AlogP 1.75
    HBond donors 6
    HBond acceptors 7
    Atoms 42
    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 canSAR1132299.