canSAR543507
FEATURES
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NAMES
    SMILES
    Nc1nc(OCc2ccccc2)c2c(ncn2CC(=O)[O-])n1.[Na+]
    InChI
    InChI=1S/C14H13N5O3.Na/c15-14-17-12-11(19(8-16-12)6-10(20)21)13(18-14)22-7-9-4-2-1-3-5-9;/h1-5,8H,6-7H2,(H,20,21)(H2,15,17,18);/q;+1/p-1
    MOLECULAR FORMULA
    C14H12N5NaO3
    CROSS REFERENCES
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    canSAR543507
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight321.08
    AlogP-3.26
    HBond donors2
    HBond acceptors8
    Atoms35
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR543507.