| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 17 | Yes |
Popular Name: 2-[4-[(2S)-2-aminobutanoyl]-1,4-diazepan-1-yl]acetamide 2-[4-[(2S)-2-aminobutanoyl]-1,4-…
| 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) | -1.70 | 0.27 | -95.77 | 6 | 6 | 2 | 95 | 244.339 | 4 | ↓ |
| Hi High (pH 8-9.5) | -1.70 | -1.36 | -46.8 | 5 | 6 | 1 | 94 | 243.331 | 4 | ↓ |
| Hi High (pH 8-9.5) | -1.70 | -0.08 | -41.24 | 5 | 6 | 1 | 94 | 243.331 | 4 | ↓ |
| Hi High (pH 8-9.5) | -1.70 | -1.71 | -11.57 | 4 | 6 | 0 | 93 | 242.323 | 4 | ↓ |
