| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 25th, 2008 | 22 | No |
Popular Name: (2R)-2-(benzenesulfonamido)-3-phenyl-propanehydroxamic (2R)-2-(benzenesulfonamido)-3-ph…
| 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) | 1.59 | 2.41 | -22.55 | 3 | 6 | 0 | 95 | 320.37 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.77 | 0.92 | -59.25 | 2 | 6 | -1 | 102 | 319.362 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.59 | 3.62 | -64.14 | 2 | 6 | -1 | 98 | 319.362 | 6 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| MMP9-1-E | Matrix Metalloproteinase 9 (cluster #1 Of 3), Eukaryotic | Eukaryotes | 730 | 0.39 | Binding ≤ 10μM |
| MMP9-1-E | Matrix Metalloproteinase 9 (cluster #1 Of 3), Eukaryotic | Eukaryotes | 1000 | 0.38 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| MMP9_HUMAN | P14780 | Matrix Metalloproteinase 9, Human | 1000 | 0.38 | Binding ≤ 1μM |
| MMP9_HUMAN | P14780 | Matrix Metalloproteinase 9, Human | 1000 | 0.38 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Activation of Matrix Metalloproteinases | |
| Assembly of collagen fibrils and other multimeric structures | |
| Collagen degradation | |
| Degradation of the extracellular matrix | |
| EPH-ephrin mediated repulsion of cells | |
| Signaling by SCF-KIT |
