| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 10th, 2009 | 27 | No |
Popular Name: 3-[1-[(2S)-3-amino-2-hydroxy-propyl]indol-3-yl]-4-phenyl-pyrrole-2,5-dione 3-[1-[(2S)-3-amino-2-hydroxy-pro…
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| 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) | 1.54 | 4.16 | -66.87 | 5 | 6 | 1 | 103 | 362.409 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.54 | 3.58 | -12.75 | 4 | 6 | 0 | 101 | 361.401 | 5 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| KCC2D-1-E | CaM Kinase II Delta (cluster #1 Of 1), Eukaryotic | Eukaryotes | 450 | 0.33 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| KCC2D_HUMAN | Q13557 | CaM Kinase II Delta, Human | 450 | 0.33 | Binding ≤ 1μM |
| KCC2D_HUMAN | Q13557 | CaM Kinase II Delta, Human | 450 | 0.33 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| CREB phosphorylation through the activation of CaMKII | |
| CREB phosphorylation through the activation of Ras | |
| HSF1-dependent transactivation | |
| Interferon gamma signaling | |
| Ras activation uopn Ca2+ infux through NMDA receptor | |
| Trafficking of AMPA receptors | |
| Unblocking of NMDA receptor, glutamate binding and activation |
