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canSAR1721960
FEATURES
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NAMES
    SMILES
    CC(=O)N1N=C(c2cccs2)CC1c1cccc([N+](=O)[O-])c1
    InChI
    InChI=1S/C15H13N3O3S/c1-10(19)17-14(9-13(16-17)15-6-3-7-22-15)11-4-2-5-12(8-11)18(20)21/h2-8,14H,9H2,1H3
    MOLECULAR FORMULA
    C15H13N3O3S
    CROSS REFERENCES
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    canSAR1721960

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 315.07
    AlogP 3.35
    HBond donors 0
    HBond acceptors 6
    Atoms 35
    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 canSAR1721960.