General Information of the Compound
| Compound ID |
CP0897146
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| Compound Name |
Molidustat sodium; sodium 1-(6-morpholinopyrimidin-4-yl)-4-(1H-1,2,3-triazol-1-yl)-1H-pyrazol-5-olate
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| Synonyms |
BAY-85-3934
HIF-PH inhibitors (anemia), Bayer
Hypoxia-inducible factor prolyl hydroxylase inhibitors (anemia)
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| Structure |
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| Formula |
C13H13N8NaO2
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| Molecular Weight |
336.291
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| Canonical SMILES |
[Na+].[O-]c1c(-n2ccnn2)cnn1-c1cc(N2CCOCC2)ncn1
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| InChI |
InChI=1S/C13H14N8O2.Na/c22-13-10(20-2-1-16-18-20)8-17-21(13)12-7-11(14-9-15-12)19-3-5-23-6-4-19;/h1-2,7-9,22H,3-6H2;/q;+1/p-1
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| InChIKey |
VYRQLKYGGSWDNH-UHFFFAOYSA-M
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Clinical Information about the Compound