| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 9th, 2010 | 23 | No |
Popular Name: ethyl ethyl
| 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) | 4.70 | 6.36 | -14.98 | 2 | 5 | 0 | 84 | 322.401 | 11 | ↓ |
| Hi High (pH 8-9.5) | 4.70 | 7.14 | -52.92 | 1 | 5 | -1 | 87 | 321.393 | 11 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| NR4A1-1-E | Nuclear Receptor Subfamily 4 Group A Member 1 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 0 | 0.00 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| NR4A1_HUMAN | P22736 | Nuclear Receptor Subfamily 4 Group A Member 1, Human | 0.115 | 0.61 | Functional ≤ 10μM |
| Description | Species |
|---|---|
| AKT phosphorylates targets in the nucleus | |
| Constitutive PI3K/AKT Signaling in Cancer | |
| Nuclear Receptor transcription pathway |
