| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 3rd, 2005 | 23 | No |
Popular Name: 2-{3-nitro-4-methylphenyl}-4-(3-pyridinylmethylene)-1,3-oxazol-5(4H)-one 2-{3-nitro-4-methylphenyl}-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) | 2.41 | 1.78 | -14.47 | 0 | 7 | 0 | 101 | 309.281 | 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 | 534 | 0.38 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| DAPK3_HUMAN | O43293 | Death-associated Protein Kinase 3, Human | 533.5 | 0.38 | Binding ≤ 1μM |
| DAPK3_HUMAN | O43293 | Death-associated Protein Kinase 3, Human | 533.5 | 0.38 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Role of DCC in regulating apoptosis |
