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canSAR106184
FEATURES
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NAMES
    SMILES
    C[C@H]1O[C@@H](n2nc(-c3ccccc3)c3c(NCC(=O)NC4CC4)ncnc32)[C@H](O)[C@@H]1O
    InChI
    InChI=1S/C21H24N6O4/c1-11-17(29)18(30)21(31-11)27-20-15(16(26-27)12-5-3-2-4-6-12)19(23-10-24-20)22-9-14(28)25-13-7-8-13/h2-6,10-11,13,17-18,21,29-30H,7-9H2,1H3,(H,25,28)(H,22,23,24)/t11-,17-,18-,21-/m1/s1
    MOLECULAR FORMULA
    C21H24N6O4
    CROSS REFERENCES
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    canSAR106184

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 424.19
    AlogP 0.82
    HBond donors 4
    HBond acceptors 10
    Atoms 55
    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 canSAR106184.