| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 20 | Yes |
Popular Name: (2R)-1-[(1S,2R)-2-amino-1-(5-bromo-2-thienyl)butyl]piperidine-2-carboxamide (2R)-1-[(1S,2R)-2-amino-1-(5-bro…
| 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) | 2.69 | 3.48 | -122.02 | 6 | 4 | 2 | 75 | 362.337 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.69 | 1.61 | -8.68 | 4 | 4 | 0 | 72 | 360.321 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.69 | 0.99 | -53.43 | 5 | 4 | 1 | 74 | 361.329 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.69 | 3.17 | -37.86 | 5 | 4 | 1 | 74 | 361.329 | 5 | ↓ |
