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canSAR790568
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NAMES
    SMILES
    NC(N)=N/N=C1\c2cc(Cl)cc(Cl)c2CC1Sc1nc2ccccc2[nH]1
    InChI
    InChI=1S/C17H14Cl2N6S/c18-8-5-10-9(11(19)6-8)7-14(15(10)24-25-16(20)21)26-17-22-12-3-1-2-4-13(12)23-17/h1-6,14H,7H2,(H,22,23)(H4,20,21,25)/b24-15+
    MOLECULAR FORMULA
    C17H14Cl2N6S
    CROSS REFERENCES
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    canSAR790568

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 404.04
    AlogP 3.56
    HBond donors 5
    HBond acceptors 6
    Atoms 40
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR790568.