| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 21 | Yes |
Popular Name: (2R)-1-[(1S,2R)-2-amino-1-(5-bromo-2-thienyl)butyl]-N,N-dimethyl-pyrrolidine-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) | 1.80 | 6.37 | -38.99 | 3 | 4 | 1 | 51 | 375.356 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.80 | 4.73 | -59.64 | 3 | 4 | 1 | 51 | 375.356 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.80 | 4.56 | -10.65 | 2 | 4 | 0 | 50 | 374.348 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.80 | 6.66 | -123.52 | 4 | 4 | 2 | 52 | 376.364 | 5 | ↓ |
