| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 18 | Yes |
Popular Name: (2R)-1-[(1S)-2-amino-1-(5-methyl-2-thienyl)ethyl]-N-methyl-pyrrolidine-2-carboxamide (2R)-1-[(1S)-2-amino-1-(5-methyl…
| 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) | 0.35 | 3.18 | -27.36 | 4 | 4 | 1 | 60 | 268.406 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.34 | 1.67 | -11.11 | 3 | 4 | 0 | 58 | 267.398 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.35 | 1.65 | -60.55 | 4 | 4 | 1 | 60 | 268.406 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.35 | 3.31 | -105 | 5 | 4 | 2 | 61 | 269.414 | 4 | ↓ |
