| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 19 | Yes |
Popular Name: (2R)-1-[(1R,2S)-2-amino-1-(5-methyl-2-thienyl)butyl]pyrrolidine-2-carboxamide (2R)-1-[(1R,2S)-2-amino-1-(5-met…
| 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) | 1.47 | 2.98 | -34.34 | 5 | 4 | 1 | 74 | 282.433 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.47 | 1.31 | -6.69 | 4 | 4 | 0 | 72 | 281.425 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.47 | 1.46 | -39.24 | 5 | 4 | 1 | 74 | 282.433 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.22 | 1.72 | -24.14 | 4 | 4 | 0 | 77 | 281.425 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.47 | 3.28 | -112.53 | 6 | 4 | 2 | 75 | 283.441 | 5 | ↓ |
