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canSAR1125596
FEATURES
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NAMES
    SMILES
    CC[C@@H](NC(=O)N1CC(=O)NCC(Cc2cc(Cl)ccc2OC)C1=O)C(=O)Nc1cccc(C(=O)O)c1
    InChI
    InChI=1S/C25H27ClN4O7/c1-3-19(22(32)28-18-6-4-5-14(11-18)24(34)35)29-25(36)30-13-21(31)27-12-16(23(30)33)9-15-10-17(26)7-8-20(15)37-2/h4-8,10-11,16,19H,3,9,12-13H2,1-2H3,(H,27,31)(H,28,32)(H,29,36)(H,34,35)/t16?,19-/m1/s1
    MOLECULAR FORMULA
    C25H27ClN4O7
    CROSS REFERENCES
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    canSAR1125596

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 530.16
    AlogP 2.29
    HBond donors 4
    HBond acceptors 11
    Atoms 64
    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 canSAR1125596.