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canSAR1769116
FEATURES
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NAMES
    SMILES
    CCc1nc(C(N)=O)c(Nc2ccc(OC)c(N3CCN(C)CC3)c2)nc1N[C@H]1CC[C@H](O)CC1
    InChI
    InChI=1S/C25H37N7O3/c1-4-19-24(27-16-5-8-18(33)9-6-16)30-25(22(29-19)23(26)34)28-17-7-10-21(35-3)20(15-17)32-13-11-31(2)12-14-32/h7,10,15-16,18,33H,4-6,8-9,11-14H2,1-3H3,(H2,26,34)(H2,27,28,30)/t16-,18-
    MOLECULAR FORMULA
    C25H37N7O3
    CROSS REFERENCES
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    canSAR1769116

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 483.30
    AlogP 2.36
    HBond donors 5
    HBond acceptors 10
    Atoms 72
    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 canSAR1769116.