| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 11th, 2010 | 20 | Yes |
Popular Name: (2S)-2-(4-bromo-2-thienyl)-2-[(2R)-2-phenylpyrrolidin-1-yl]ethanamine (2S)-2-(4-bromo-2-thienyl)-2-[(2…
| 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) | 3.35 | 8.44 | -120.87 | 4 | 2 | 2 | 32 | 353.329 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.35 | 7.15 | -3.32 | 2 | 2 | 0 | 29 | 351.313 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.35 | 6.73 | -47.99 | 3 | 2 | 1 | 31 | 352.321 | 4 | ↓ |
