canSAR823840
FEATURES
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NAMES
    SMILES
    O=C(Cn1cc(CCO)nn1)N[C@@H]1[C@@H](O)C=C(C(=O)O)O[C@H]1[C@H](O)[C@H](O)CO
    InChI
    InChI=1S/C15H22N4O9/c20-2-1-7-4-19(18-17-7)5-11(24)16-12-8(22)3-10(15(26)27)28-14(12)13(25)9(23)6-21/h3-4,8-9,12-14,20-23,25H,1-2,5-6H2,(H,16,24)(H,26,27)/t8-,9+,12+,13+,14+/m0/s1
    MOLECULAR FORMULA
    C15H22N4O9
    CROSS REFERENCES
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    canSAR823840
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight402.14
    AlogP-4.26
    HBond donors7
    HBond acceptors13
    Atoms50
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR823840.