| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 26th, 2008 | 15 | Yes |
Popular Name: 2-Quinolinecarboxylic acid, 4-hydroxy-5-methyl- (9CI) 2-Quinolinecarboxylic acid, 4-hy…
Find On: PubMed — Wikipedia — Google
CAS Number: 36303-31-8
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 1.93 | 4.58 | -44.8 | 1 | 4 | -1 | 73 | 202.189 | 1 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z104302-4-O | Glutamate NMDA Receptor (cluster #4 Of 7), Other | Other | 2100 | 0.53 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z104302 | Z104302 | Glutamate NMDA Receptor | 2100 | 0.53 | Binding ≤ 10μM |
No pre-computed analogs available. Try a structural similarity search.