| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 8th, 2010 | 27 | Yes |
Popular Name: ASK1 Inhibitor 10 ASK1 Inhibitor 10
Find On: PubMed — Wikipedia — Google
CAS Number: 1005775-56-3
| 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) | 3.52 | 13.04 | -11.5 | 1 | 6 | 0 | 64 | 359.433 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.52 | 13.55 | -42.17 | 2 | 6 | 1 | 65 | 360.441 | 4 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| M3K5-1-E | Mitogen-activated Protein Kinase Kinase Kinase 5 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 14 | 0.41 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| M3K5_HUMAN | Q99683 | Mitogen-activated Protein Kinase Kinase Kinase 5, Human | 14 | 0.41 | Binding ≤ 1μM |
| M3K5_HUMAN | Q99683 | Mitogen-activated Protein Kinase Kinase Kinase 5, Human | 14 | 0.41 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Oxidative Stress Induced Senescence |
No pre-computed analogs available. Try a structural similarity search.