| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 20 | Yes |
Popular Name: (1S,2R)-1-(5-bromo-2-thienyl)-1-[4-(dimethylaminomethyl)-1-piperidyl]propan-2-amine (1S,2R)-1-(5-bromo-2-thienyl)-1-…
| 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) | 2.77 | 6.82 | -90.1 | 4 | 3 | 2 | 35 | 362.381 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.77 | 8.32 | -96.18 | 4 | 3 | 2 | 35 | 362.381 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.77 | 6.5 | -35.03 | 3 | 3 | 1 | 34 | 361.373 | 5 | ↓ |
