| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 18 | Yes |
Popular Name: 4-[(5R)-5-ethyl-1,4-diazepan-1-yl]-N-isopropyl-N-methyl-butan-1-amine 4-[(5R)-5-ethyl-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) | 2.37 | 6.91 | -78.43 | 3 | 3 | 2 | 24 | 257.466 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.37 | 8.03 | -85.92 | 3 | 3 | 2 | 21 | 257.466 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.37 | 9.19 | -180.58 | 4 | 3 | 3 | 25 | 258.474 | 7 | ↓ |
