| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 18 | Yes |
Popular Name: 4-[4-[[(2S)-tetrahydrofuran-2-yl]methyl]-1,4-diazepan-1-yl]butan-1-amine 4-[4-[[(2S)-tetrahydrofuran-2-yl…
| 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) | 0.22 | 3.54 | -93.14 | 4 | 4 | 2 | 45 | 257.422 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.22 | 1.63 | -42.6 | 3 | 4 | 1 | 43 | 256.414 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 0.22 | 5.82 | -179.05 | 5 | 4 | 3 | 46 | 258.43 | 6 | ↓ |
