| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 16 | No |
Popular Name: (2S)-2-(5-methyl-2-furyl)-2-(1,4-thiazepan-4-yl)ethanamine (2S)-2-(5-methyl-2-furyl)-2-(1,4…
| 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) | 0.87 | 5.69 | -125.87 | 4 | 3 | 2 | 45 | 242.388 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.87 | 5.25 | -29.64 | 3 | 3 | 1 | 44 | 241.38 | 3 | ↓ |
