| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 21st, 2006 | 26 | Yes |
| 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) | 3.80 | 7.91 | -47.13 | 0 | 4 | -1 | 62 | 362.792 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.52 | 8.9 | -13.94 | 0 | 4 | 0 | 56 | 363.8 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.52 | 8.56 | -13 | 0 | 4 | 0 | 56 | 363.8 | 3 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| NMDZ1-3-E | Glutamate (NMDA) Receptor Subunit Zeta 1 (cluster #3 Of 6), Eukaryotic | Eukaryotes | 2 | 0.47 | Binding ≤ 10μM |
| NMDE2-2-E | Glutamate [NMDA] Receptor Subunit Epsilon 2 (cluster #2 Of 2), Eukaryotic | Eukaryotes | 18 | 0.42 | Functional ≤ 10μM |
| NMDZ1-3-E | Glutamate (NMDA) Receptor Subunit Zeta 1 (cluster #3 Of 3), Eukaryotic | Eukaryotes | 18 | 0.42 | Functional ≤ 10μM |
| Z104302-4-O | Glutamate NMDA Receptor (cluster #4 Of 7), Other | Other | 2 | 0.47 | Binding ≤ 10μM |
| Z50597-1-O | Rattus Norvegicus (cluster #1 Of 12), Other | Other | 31 | 0.40 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| NMDZ1_RAT | P35439 | Glutamate (NMDA) Receptor Subunit Zeta 1, Rat | 14 | 0.42 | Binding ≤ 1μM |
| Z104302 | Z104302 | Glutamate NMDA Receptor | 1.4 | 0.48 | Binding ≤ 1μM |
| NMDZ1_RAT | P35439 | Glutamate (NMDA) Receptor Subunit Zeta 1, Rat | 14 | 0.42 | Binding ≤ 10μM |
| Z104302 | Z104302 | Glutamate NMDA Receptor | 1.4 | 0.48 | Binding ≤ 10μM |
| NMDZ1_RAT | P35439 | Glutamate (NMDA) Receptor Subunit Zeta 1, Rat | 18 | 0.42 | Functional ≤ 10μM |
| NMDE2_RAT | Q00960 | Glutamate [NMDA] Receptor Subunit Epsilon 2, Rat | 18 | 0.42 | Functional ≤ 10μM |
| Z50597 | Z50597 | Rattus Norvegicus | 31 | 0.40 | Functional ≤ 10μM |
| Description | Species |
|---|---|
| CREB phosphorylation through the activation of CaMKII | |
| EPHB-mediated forward signaling | |
| Ras activation uopn Ca2+ infux through NMDA receptor | |
| Unblocking of NMDA receptor, glutamate binding and activation |
No pre-computed analogs available. Try a structural similarity search.