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canSAR1635393
FEATURES
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NAMES
    SMILES
    C=CCn1c(SCC(=O)Nc2nc3ccccc3s2)nc(=O)c(CC)c1O
    InChI
    InChI=1S/C18H18N4O3S2/c1-3-9-22-16(25)11(4-2)15(24)21-18(22)26-10-14(23)20-17-19-12-7-5-6-8-13(12)27-17/h3,5-8,25H,1,4,9-10H2,2H3,(H,19,20,23)
    MOLECULAR FORMULA
    C18H18N4O3S2
    CROSS REFERENCES
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    canSAR1635393

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 402.08
    AlogP 3.04
    HBond donors 2
    HBond acceptors 7
    Atoms 45
    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 canSAR1635393.