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canSAR1986218
FEATURES
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NAMES
    SMILES
    Cc1n[nH]c(C)c1Sc1ccccc1/N=C/c1cc(Cl)cc([N+](=O)[O-])c1O
    InChI
    InChI=1S/C18H15ClN4O3S/c1-10-18(11(2)22-21-10)27-16-6-4-3-5-14(16)20-9-12-7-13(19)8-15(17(12)24)23(25)26/h3-9,24H,1-2H3,(H,21,22)/b20-9+
    MOLECULAR FORMULA
    C18H15ClN4O3S
    CROSS REFERENCES
    1986218 logo

    canSAR1986218

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 402.06
    AlogP 5.20
    HBond donors 2
    HBond acceptors 7
    Atoms 42
    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 canSAR1986218.