| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 28th, 2005 | 23 | No |
Popular Name: 2-(4-chloro-3-nitro-phenyl)-4-(3-pyridylmethylene)oxazol-5-one 2-(4-chloro-3-nitro-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) | 2.64 | 1.43 | -13.86 | 0 | 7 | 0 | 101 | 329.699 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.64 | 1.53 | -54.99 | 1 | 7 | 1 | 103 | 330.707 | 3 | ↓ |
| 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 | 0.40 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| DAPK3_HUMAN | O43293 | Death-associated Protein Kinase 3, Human | 278.5 | 0.40 | Binding ≤ 1μM |
| DAPK3_HUMAN | O43293 | Death-associated Protein Kinase 3, Human | 278.5 | 0.40 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Role of DCC in regulating apoptosis |
