| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 11th, 2010 | 18 | Yes |
Popular Name: (3S)-1-[(1S)-2-amino-1-(4-bromo-2-thienyl)ethyl]piperidine-3-carboxamide (3S)-1-[(1S)-2-amino-1-(4-bromo-…
| 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 | 0.38 | -55.93 | 5 | 4 | 1 | 74 | 333.275 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.87 | 0.02 | -9.05 | 4 | 4 | 0 | 72 | 332.267 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.87 | 2.21 | -37.78 | 5 | 4 | 1 | 74 | 333.275 | 4 | ↓ |
