| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2011 | 19 | Yes |
Popular Name: (3S)-1-(1,4-diazepane-1-carbonyl)-3-methyl-piperidine-3-carboxylic (3S)-1-(1,4-diazepane-1-carbonyl…
| 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) | 0.07 | 5.69 | -92.74 | 2 | 6 | 0 | 80 | 269.345 | 1 | ↓ |
| Hi High (pH 8-9.5) | 0.07 | 4.01 | -55.36 | 1 | 6 | -1 | 76 | 268.337 | 1 | ↓ |
