| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 7th, 2009 | 26 | Yes |
Popular Name: 1-[[1-(2-dimethylaminoethyl)benzimidazol-2-yl]methyl]-3,4-dihydroquinolin-2-one 1-[[1-(2-dimethylaminoethyl)benz…
| 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) | 2.30 | 11.97 | -42.37 | 1 | 5 | 1 | 43 | 349.458 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.30 | 9.43 | -9.43 | 0 | 5 | 0 | 41 | 348.45 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.30 | 12.37 | -87.88 | 2 | 5 | 2 | 44 | 350.466 | 5 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50678-2-O | Respiratory Syncytial Virus (cluster #2 Of 2), Other | Other | 456 | 0.34 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50678 | Z50678 | Respiratory Syncytial Virus | 456 | 0.34 | Functional ≤ 10μM |
