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canSAR83314
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NAMES
    SMILES
    COc1cc(CCNc2ccc3nc(N)nc(N)c3c2Cl)cc(OC)c1OC
    InChI
    InChI=1S/C19H22ClN5O3/c1-26-13-8-10(9-14(27-2)17(13)28-3)6-7-23-12-5-4-11-15(16(12)20)18(21)25-19(22)24-11/h4-5,8-9,23H,6-7H2,1-3H3,(H4,21,22,24,25)
    MOLECULAR FORMULA
    C19H22ClN5O3
    CROSS REFERENCES
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    canSAR83314

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 403.14
    AlogP 3.13
    HBond donors 5
    HBond acceptors 8
    Atoms 50
    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 canSAR83314.