canSAR1604290
FEATURES
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NAMES
    SMILES
    Sc1nnc(-c2cc(-c3ccccc3)[nH]n2)n1N=Cc1c2ccccc2cc2ccccc12
    InChI
    InChI=1S/C26H18N6S/c33-26-31-30-25(24-15-23(28-29-24)17-8-2-1-3-9-17)32(26)27-16-22-20-12-6-4-10-18(20)14-19-11-5-7-13-21(19)22/h1-16H,(H,28,29)(H,31,33)
    MOLECULAR FORMULA
    C26H18N6S
    CROSS REFERENCES
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    canSAR1604290
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight446.13
    AlogP5.81
    HBond donors1
    HBond acceptors6
    Atoms51
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1604290.