| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2010 | 18 | No |
Popular Name: (2S)-2-methyl-2-phenyl-3-(1,4-thiazepan-4-yl)propan-1-amine (2S)-2-methyl-2-phenyl-3-(1,4-th…
| 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) | 2.02 | 6.94 | -47.03 | 3 | 2 | 1 | 31 | 265.446 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.02 | 6.62 | -1.81 | 2 | 2 | 0 | 29 | 264.438 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.02 | 7.4 | -33.56 | 3 | 2 | 1 | 30 | 265.446 | 4 | ↓ |
