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canSAR1509567
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NAMES
    SMILES
    O=C(Nc1ncc(Cc2cc(Cl)ccc2Cl)s1)c1ccc([N+](=O)[O-])cc1
    InChI
    InChI=1S/C17H11Cl2N3O3S/c18-12-3-6-15(19)11(7-12)8-14-9-20-17(26-14)21-16(23)10-1-4-13(5-2-10)22(24)25/h1-7,9H,8H2,(H,20,21,23)
    MOLECULAR FORMULA
    C17H11Cl2N3O3S
    CROSS REFERENCES
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    canSAR1509567

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 406.99
    AlogP 5.20
    HBond donors 1
    HBond acceptors 6
    Atoms 37
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1509567.