| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 25th, 2004 | 29 | Yes |
Popular Name: 2-[4-(1-amino-2,4-dicyano-pyrido[1,2-a]benzimidazol-3-yl)phenoxy]acetamide 2-[4-(1-amino-2,4-dicyano-pyrido…
| 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) | 2.31 | 7.5 | -23.18 | 4 | 8 | 0 | 143 | 382.383 | 4 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| PERF-1-E | Perforin-1 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 5190 | 0.26 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| PERF_HUMAN | P14222 | Perforin-1, Human | 5190 | 0.26 | Binding ≤ 10μM |
