Doconexent
Representations & DB's id
| ||
| ChEBI: | CHEBI:28125 | |
|---|---|---|
| ChEMBL: | CHEMBL367149 | |
| PubChem: | 445580 | |
| IUPAC: | (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoic acid | |
| Standard InChI: | InChI=1S/C22H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h3-4,6-7,9-10,12-13,15-16,18-19H,2,5,8,11,14,17,20-21H2,1H3,(H,23,24)/b4-3-,7-6-,10-9-,13-12-,16-15-,19-18- | |
| Standard InChI Key: | MBMBGCFOFBJSGT-KUBAVDMBSA-N | |
| SMILES: | CC/C=CC/C=CC/C=CC/C=CC/C=CC/C=CCCC(=O)O | |
Molecular propeties
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| AlogP: | 6.55 | |
|---|---|---|
| Hydrogen bonds acceptors: | 1 | |
| Hydrogen bonds donors: | 1 | |
| Rotatable bonds: | 14 | |
| Number of rings: | 0 | |
| Molecular Weight: | 328.24 | |
| Topological polar surface area: | 37.3 | |
| Number of aromatic rings: | 0 | |
| Fsp3: | 0.409 | |
| Number of carbons: | 22 | |