| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 20 | Yes |
Popular Name: 4-[(1S)-3-amino-1-ethyl-propyl]-N-butyl-1,4-diazepane-1-carboxamide 4-[(1S)-3-amino-1-ethyl-propyl]-…
| 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) | 2.09 | 5.63 | -128.46 | 5 | 5 | 2 | 64 | 286.464 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.09 | 5.24 | -42.57 | 4 | 5 | 1 | 63 | 285.456 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.09 | 4.34 | -55.06 | 4 | 5 | 1 | 63 | 285.456 | 7 | ↓ |
