| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2008 | 21 | Yes |
Popular Name: (2S)-2-[(3-cyanobenzoyl)amino]-3-(1H-imidazol-4-yl)propanoic (2S)-2-[(3-cyanobenzoyl)amino]-3…
| 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) | -1.33 | 5.26 | -56.31 | 2 | 7 | -1 | 122 | 283.267 | 5 | ↓ |
| Mid Mid (pH 6-8) | -1.33 | 5.77 | -72.75 | 3 | 7 | 0 | 123 | 284.275 | 5 | ↓ |
| Mid Mid (pH 6-8) | -1.33 | 6.35 | -66.58 | 2 | 7 | -1 | 122 | 283.267 | 5 | ↓ |
