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canSAR1122334
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NAMES
    SMILES
    O=C(CCc1ccccc1)Nc1ccc2nc3c4[nH]c5ccccc5c4ccn3c(=O)c2c1
    InChI
    InChI=1S/C27H20N4O2/c32-24(13-10-17-6-2-1-3-7-17)28-18-11-12-23-21(16-18)27(33)31-15-14-20-19-8-4-5-9-22(19)29-25(20)26(31)30-23/h1-9,11-12,14-16,29H,10,13H2,(H,28,32)
    MOLECULAR FORMULA
    C27H20N4O2
    CROSS REFERENCES
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    canSAR1122334

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 432.16
    AlogP 5.05
    HBond donors 2
    HBond acceptors 6
    Atoms 53
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1122334.