Pterin-6-Carboxylic Acid
Representations & DB's id
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| ChEBI: | CHEBI:88937 | |
|---|---|---|
| ChEMBL: | CHEMBL566727 | |
| PubChem: | 70361 | |
| IUPAC: | 2-amino-4-oxo-1H-pteridine-6-carboxylic acid | |
| Standard InChI: | InChI=1S/C7H5N5O3/c8-7-11-4-3(5(13)12-7)10-2(1-9-4)6(14)15/h1H,(H,14,15)(H3,8,9,11,12,13) | |
| Standard InChI Key: | QABAUCFGPWONOG-UHFFFAOYSA-N | |
| SMILES: | Oc1nc(=N)[nH]c2c1nc(cn2)C(=O)O | |
Molecular propeties
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| AlogP: | -1.01 | |
|---|---|---|
| Hydrogen bonds acceptors: | 6 | |
| Hydrogen bonds donors: | 3 | |
| Rotatable bonds: | 1 | |
| Number of rings: | 2 | |
| Molecular Weight: | 207.04 | |
| Topological polar surface area: | 131 | |
| Number of aromatic rings: | 2 | |
| Fsp3: | 0 | |
| Number of carbons: | 7 | |
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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