| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2007 | 22 | No |
Popular Name: 2-[(3-cyano-4-ethyl-5-hydroxy-7,7-dimethyl-6,8-dihydro-4H-quinolin-2-yl)sulfanyl]acetamide 2-[(3-cyano-4-ethyl-5-hydroxy-7,…
| 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) | 1.68 | -2.67 | -20.19 | 2 | 5 | 0 | 96 | 319.43 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.22 | -4.92 | -15.79 | 2 | 5 | 0 | 96 | 319.43 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.06 | -1.89 | -17.75 | 2 | 5 | 0 | 96 | 319.43 | 4 | ↓ |
