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canSAR790314
FEATURES
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NAMES
    SMILES
    CC[C@H](C)[C@@H](Nc1ccc(Cl)c(Cl)c1)C(=O)N[C@H](Cc1cc2ccccc2[nH]1)C(=O)NO
    InChI
    InChI=1S/C23H26Cl2N4O3/c1-3-13(2)21(27-15-8-9-17(24)18(25)11-15)23(31)28-20(22(30)29-32)12-16-10-14-6-4-5-7-19(14)26-16/h4-11,13,20-21,26-27,32H,3,12H2,1-2H3,(H,28,31)(H,29,30)/t13-,20+,21+/m0/s1
    MOLECULAR FORMULA
    C23H26Cl2N4O3
    CROSS REFERENCES
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    canSAR790314

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 476.14
    AlogP 4.53
    HBond donors 5
    HBond acceptors 7
    Atoms 58
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR790314.