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canSAR1157012
FEATURES
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NAMES
    SMILES
    N#CC1c2ccccc2OC(c2ccccc2O)N1c1ccccc1
    InChI
    InChI=1S/C21H16N2O2/c22-14-18-16-10-5-7-13-20(16)25-21(17-11-4-6-12-19(17)24)23(18)15-8-2-1-3-9-15/h1-13,18,21,24H
    MOLECULAR FORMULA
    C21H16N2O2
    CROSS REFERENCES
    1157012 logo

    canSAR1157012

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 328.12
    AlogP 4.55
    HBond donors 1
    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 canSAR1157012.