| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2008 | 19 | Yes |
Popular Name: (1S,2S)-2-(4-methyl1,4-diazepane-1-carbonyl)cyclohexane-1-carboxylic (1S,2S)-2-(4-methyl1,4-diazepane…
| 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) | 1.23 | 8.18 | -76.54 | 1 | 5 | 0 | 65 | 268.357 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.23 | 5.67 | -67.62 | 0 | 5 | -1 | 64 | 267.349 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.23 | 7.05 | -44.67 | 2 | 5 | 1 | 62 | 269.365 | 2 | ↓ |
