| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 12th, 2008 | 20 | No |
Popular Name: (4S)-5-acetyl-4-(4-chlorophenyl)-6-methyl-2-sulfanyl-1,4-dihydropyridine-3-carbonitrile (4S)-5-acetyl-4-(4-chlorophenyl)…
| 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) | 3.47 | 8.25 | -37.46 | 1 | 3 | -1 | 53 | 303.794 | 2 | ↓ |
| Mid Mid (pH 6-8) | 3.99 | -0.4 | -8.66 | 0 | 3 | 0 | 53 | 304.802 | 2 | ↓ |
| Mid Mid (pH 6-8) | 3.99 | 1.66 | -15.45 | 0 | 3 | 0 | 53 | 304.802 | 2 | ↓ |
| Mid Mid (pH 6-8) | 3.81 | -0.37 | -7.33 | 0 | 3 | 0 | 53 | 304.802 | 2 | ↓ |
