| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 28th, 2009 | 28 | Yes |
Popular Name: 1-[3-[4-[3-(aminomethyl)phenyl]piperidine-1-carbonyl]indol-1-yl]ethanone 1-[3-[4-[3-(aminomethyl)phenyl]p…
| 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) | 3.01 | 9.48 | -65.51 | 3 | 5 | 1 | 70 | 376.48 | 3 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| TRYB1-1-E | Tryptase Beta-1 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 240 | 0.33 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| TRYB1_HUMAN | Q15661 | Tryptase Beta-1, Human | 240 | 0.33 | Binding ≤ 1μM |
| TRYB1_HUMAN | Q15661 | Tryptase Beta-1, Human | 240 | 0.33 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Activation of Matrix Metalloproteinases |
