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canSAR1766451
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NAMES
    SMILES
    Cc1oc(-c2ccccc2NC(=O)C2CCCO2)nc1CNC(=O)c1[nH]c2c(C)ccc(C)c2c1C
    InChI
    InChI=1S/C28H30N4O4/c1-15-11-12-16(2)24-23(15)17(3)25(32-24)27(34)29-14-21-18(4)36-28(31-21)19-8-5-6-9-20(19)30-26(33)22-10-7-13-35-22/h5-6,8-9,11-12,22,32H,7,10,13-14H2,1-4H3,(H,29,34)(H,30,33)
    MOLECULAR FORMULA
    C28H30N4O4
    CROSS REFERENCES
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    canSAR1766451

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 486.23
    AlogP 5.10
    HBond donors 3
    HBond acceptors 8
    Atoms 66
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1766451.