canSAR2101470
FEATURES
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NAMES
    SMILES
    Cc1nn(-c2ccnc(Nc3ccc4c(c3)c(Cl)c(C)n4C)n2)cc1CCN1CC[C@H](O)C1
    InChI
    InChI=1S/C24H28ClN7O/c1-15-17(7-10-31-11-8-19(33)14-31)13-32(29-15)22-6-9-26-24(28-22)27-18-4-5-21-20(12-18)23(25)16(2)30(21)3/h4-6,9,12-13,19,33H,7-8,10-11,14H2,1-3H3,(H,26,27,28)/t19-/m0/s1
    MOLECULAR FORMULA
    C24H28ClN7O
    CROSS REFERENCES
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    canSAR2101470
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight465.20
    AlogP3.78
    HBond donors2
    HBond acceptors8
    Atoms61
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2101470.