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canSAR992179
FEATURES
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NAMES
    SMILES
    CCC[C@H](NC[C@@H](NC[C@@H](N)CS)[C@H](C)CC)C(=O)N[C@@H](CCO)C(=O)O
    InChI
    InChI=1S/C18H38N4O4S/c1-4-6-14(17(24)22-15(7-8-23)18(25)26)21-10-16(12(3)5-2)20-9-13(19)11-27/h12-16,20-21,23,27H,4-11,19H2,1-3H3,(H,22,24)(H,25,26)/t12-,13-,14+,15+,16-/m1/s1
    MOLECULAR FORMULA
    C18H38N4O4S
    CROSS REFERENCES
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    canSAR992179

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 406.26
    AlogP -0.04
    HBond donors 7
    HBond acceptors 8
    Atoms 65
    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 canSAR992179.