| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 6th, 2006 | 21 | No |
Popular Name: 2-(4-bromo-3-methyl-phenyl)-4-(3-pyridylmethylene)oxazol-5-one 2-(4-bromo-3-methyl-phenyl)-4-(3…
| 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) | 3.26 | 8.21 | -8.11 | 0 | 4 | 0 | 56 | 343.18 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 3.26 | 8.49 | -44.53 | 1 | 4 | 1 | 57 | 344.188 | 2 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| DAPK3-1-E | Death-associated Protein Kinase 3 (cluster #1 Of 2), Eukaryotic | Eukaryotes | 279 | 0.44 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| DAPK3_HUMAN | O43293 | Death-associated Protein Kinase 3, Human | 278.5 | 0.44 | Binding ≤ 1μM |
| DAPK3_HUMAN | O43293 | Death-associated Protein Kinase 3, Human | 278.5 | 0.44 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Role of DCC in regulating apoptosis |
