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canSAR1859483
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NAMES
    SMILES
    CCc1ncnc(-c2ccc(C(=O)N3CCC(C)(O)CC3)c(C)c2)c1C#Cc1ccc(N)nc1
    InChI
    InChI=1S/C27H29N5O2/c1-4-23-22(8-5-19-6-10-24(28)29-16-19)25(31-17-30-23)20-7-9-21(18(2)15-20)26(33)32-13-11-27(3,34)12-14-32/h6-7,9-10,15-17,34H,4,11-14H2,1-3H3,(H2,28,29)
    MOLECULAR FORMULA
    C27H29N5O2
    CROSS REFERENCES
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    canSAR1859483

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 455.23
    AlogP 3.38
    HBond donors 3
    HBond acceptors 7
    Atoms 63
    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 canSAR1859483.