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canSAR113243
FEATURES
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NAMES
    SMILES
    CC(C)C[C@H](NC(=O)Nc1cccc(Cl)c1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NCCC(=O)O
    InChI
    InChI=1S/C27H32ClN5O5/c1-16(2)12-22(33-27(38)31-19-7-5-6-18(28)14-19)26(37)32-23(25(36)29-11-10-24(34)35)13-17-15-30-21-9-4-3-8-20(17)21/h3-9,14-16,22-23,30H,10-13H2,1-2H3,(H,29,36)(H,32,37)(H,34,35)(H2,31,33,38)/t22-,23+/m0/s1
    MOLECULAR FORMULA
    C27H32ClN5O5
    CROSS REFERENCES
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    canSAR113243

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 541.21
    AlogP 3.68
    HBond donors 6
    HBond acceptors 10
    Atoms 70
    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 canSAR113243.