| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 21st, 2009 | 18 | Yes |
Popular Name: (2S)-N-[(5-bromo-3-thienyl)methyl]-2-methyl-3-(1-piperidyl)propan-1-amine (2S)-N-[(5-bromo-3-thienyl)methy…
| 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) | 3.70 | 9.57 | -108.75 | 3 | 2 | 2 | 21 | 333.339 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.70 | 7.63 | -43.85 | 2 | 2 | 1 | 20 | 332.331 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.70 | 8.38 | -33.61 | 2 | 2 | 1 | 16 | 332.331 | 6 | ↓ |
