| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 15th, 2010 | 16 | Yes |
Popular Name: (5S)-5-ethyl-1-[2-[(2S)-tetrahydrofuran-2-yl]ethyl]-1,4-diazepane (5S)-5-ethyl-1-[2-[(2S)-tetrahyd…
| 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) | 1.40 | 4.45 | -34.95 | 2 | 3 | 1 | 29 | 227.372 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.40 | 5.22 | -31.88 | 2 | 3 | 1 | 26 | 227.372 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.40 | 6.32 | -107.01 | 3 | 3 | 2 | 30 | 228.38 | 4 | ↓ |
