| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 11th, 2009 | 15 | Yes |
Popular Name: (2S)-2-amino-1-(1,4-diazepan-1-yl)-4-methyl-pentan-1-one (2S)-2-amino-1-(1,4-diazepan-1-y…
| 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) | -0.25 | 2.53 | -97.26 | 5 | 4 | 2 | 65 | 215.341 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.25 | 0.94 | -5.95 | 3 | 4 | 0 | 58 | 213.325 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.25 | 2.23 | -45.26 | 4 | 4 | 1 | 63 | 214.333 | 3 | ↓ |
