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canSAR1016242
FEATURES
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NAMES
    SMILES
    CC1=NNC(=O)/C1=C/c1c(-c2ccccc2)[nH]c2ccc(C)cc12
    InChI
    InChI=1S/C20H17N3O/c1-12-8-9-18-16(10-12)17(11-15-13(2)22-23-20(15)24)19(21-18)14-6-4-3-5-7-14/h3-11,21H,1-2H3,(H,23,24)/b15-11+
    MOLECULAR FORMULA
    C20H17N3O
    CROSS REFERENCES
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    canSAR1016242

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 315.14
    AlogP 4.03
    HBond donors 2
    HBond acceptors 4
    Atoms 41
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1016242.