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canSAR1638113
FEATURES
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NAMES
    SMILES
    Cl.N[C@@H](Cc1ccc(O)cc1)c1nnc([C@H](CC(=O)O)NC(=O)C2CCNCC2)o1
    InChI
    InChI=1S/C19H25N5O5.ClH/c20-14(9-11-1-3-13(25)4-2-11)18-23-24-19(29-18)15(10-16(26)27)22-17(28)12-5-7-21-8-6-12;/h1-4,12,14-15,21,25H,5-10,20H2,(H,22,28)(H,26,27);1H/t14-,15-;/m0./s1
    MOLECULAR FORMULA
    C19H26ClN5O5
    CROSS REFERENCES
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    canSAR1638113

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 439.16
    AlogP 1.07
    HBond donors 6
    HBond acceptors 10
    Atoms 56
    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 canSAR1638113.