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canSAR660140
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NAMES
    SMILES
    CCCCc1cn(-c2ccc(C(=O)Nc3ccc4[nH]c(N)nc4c3)cc2)nn1.Cl
    InChI
    InChI=1S/C20H21N7O.ClH/c1-2-3-4-15-12-27(26-25-15)16-8-5-13(6-9-16)19(28)22-14-7-10-17-18(11-14)24-20(21)23-17;/h5-12H,2-4H2,1H3,(H,22,28)(H3,21,23,24);1H
    MOLECULAR FORMULA
    C20H22ClN7O
    CROSS REFERENCES
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    canSAR660140

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 411.16
    AlogP 3.74
    HBond donors 4
    HBond acceptors 8
    Atoms 51
    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 canSAR660140.