| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 28th, 2009 | 30 | Yes |
Popular Name: 2-[(4-acetylpiperazin-1-yl)methyl]-3-(2-ethoxyphenyl)quinazolin-4-one 2-[(4-acetylpiperazin-1-yl)methy…
| 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) | 2.08 | 9.38 | -19.4 | 0 | 7 | 0 | 68 | 406.486 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.08 | 11.5 | -53.05 | 1 | 7 | 1 | 69 | 407.494 | 5 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| HIF1A-1-E | Hypoxia-inducible Factor 1-alpha (cluster #1 Of 2), Eukaryotic | Eukaryotes | 470 | 0.30 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| HIF1A_HUMAN | Q16665 | Hypoxia-inducible Factor 1 Alpha, Human | 470 | 0.30 | Binding ≤ 1μM |
| HIF1A_HUMAN | Q16665 | Hypoxia-inducible Factor 1 Alpha, Human | 470 | 0.30 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Circadian Clock | |
| NOTCH1 Intracellular Domain Regulates Transcription | |
| Oxygen-dependent asparagine hydroxylation of Hypoxia-inducible Factor Alpha | |
| Oxygen-dependent proline hydroxylation of Hypoxia-inducible Factor Alpha | |
| Regulation of gene expression by Hypoxia-inducible Factor |
