| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 21 | Yes |
Popular Name: (2S,3S)-2-amino-N-[(3R)-1-benzylpyrrolidin-3-yl]-3-methyl-pentanamide (2S,3S)-2-amino-N-[(3R)-1-benzyl…
| 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) | 1.45 | 6.63 | -100.83 | 5 | 4 | 2 | 61 | 291.439 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.64 | 4.34 | -60.76 | 4 | 4 | 1 | 67 | 290.431 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.45 | 6.3 | -44.72 | 4 | 4 | 1 | 60 | 290.431 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.64 | 3.92 | -39.77 | 3 | 4 | 0 | 66 | 289.423 | 6 | ↓ |
