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Small molecule Approved FDA
ChEMBL DrugBank Drug Central Drugs@FDA KEGG MeSH PubChem repoDB

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Chemistry

Mol. Mass

530.18

ALogP

2.09

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: Cc1cc(OP(=O)([O-])[O-])c2ccccc2c1OP(=O)([O-])[O-].O.O.O.O.O.O.[Na+].[Na+].[Na+].[Na+]
  • InChIKey: QIWDGSYHBCMXSI-UHFFFAOYSA-J
    InChI=1S/C11H12O8P2.4Na.6H2O/c1-7-6-10(18-20(12,13)14)8-4-2-3-5-9(8)11(7)19-21(15,16)17;;;;;;;;;;/h2-6H,1H3,(H2,12,13,14)(H2,15,16,17);;;;;6*1H2/q;4*+1;;;;;;/p-4
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL3989728   ChEMBL
menadiol sodium diphosphate *

CHEMBL1201076   ChEMBL

CHEMBL1479848   ChEMBL
acetomenaphthone

CHEMBL2106883   ChEMBL
menadiol sodium sulfate

CHEMBL2110691   ChEMBL
menadoxime

Kappadione   Wikipedia

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