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canSAR2204851
FEATURES
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NAMES
    SMILES
    COc1ccnc(NC(=O)c2ccc(-c3nc([C@@H]4CC[C@H]5CCC(=O)N5C4)n4c(Cl)cnc(N)c34)c(OC)c2)c1
    InChI
    InChI=1S/C28H28ClN7O4/c1-39-18-9-10-31-22(12-18)33-28(38)15-4-7-19(20(11-15)40-2)24-25-26(30)32-13-21(29)36(25)27(34-24)16-3-5-17-6-8-23(37)35(17)14-16/h4,7,9-13,16-17H,3,5-6,8,14H2,1-2H3,(H2,30,32)(H,31,33,38)/t16-,17+/m1/s1
    MOLECULAR FORMULA
    C28H28ClN7O4
    CROSS REFERENCES
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    canSAR2204851

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 561.19
    AlogP 4.16
    HBond donors 3
    HBond acceptors 11
    Atoms 68
    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 canSAR2204851.