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canSAR1445396
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NAMES
    SMILES
    O=C(Cn1cnc2c(oc3nc4c(cc32)CCCC4)c1=O)Nc1ccccc1
    InChI
    InChI=1S/C21H18N4O3/c26-17(23-14-7-2-1-3-8-14)11-25-12-22-18-15-10-13-6-4-5-9-16(13)24-20(15)28-19(18)21(25)27/h1-3,7-8,10,12H,4-6,9,11H2,(H,23,26)
    MOLECULAR FORMULA
    C21H18N4O3
    CROSS REFERENCES
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    canSAR1445396

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 374.14
    AlogP 3.06
    HBond donors 1
    HBond acceptors 7
    Atoms 46
    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 canSAR1445396.