| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2010 | 18 | Yes |
Popular Name: (2S)-1-[(1R)-2-amino-1-phenyl-ethyl]-N-methyl-pyrrolidine-2-carboxamide (2S)-1-[(1R)-2-amino-1-phenyl-et…
| 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) | 0.23 | 4.33 | -115.78 | 5 | 4 | 2 | 61 | 249.358 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.23 | 3.89 | -29.97 | 4 | 4 | 1 | 60 | 248.35 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.23 | 1.71 | -40.99 | 4 | 4 | 1 | 60 | 248.35 | 4 | ↓ |
