| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 18 | Yes |
Popular Name: (2S)-2-amino-3-methyl-1-[(2S)-2-(3-methylisoxazol-5-yl)pyrrolidin-1-yl]butan-1-one (2S)-2-amino-3-methyl-1-[(2S)-2-…
| 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) | 0.58 | 3.8 | -47.7 | 3 | 5 | 1 | 74 | 252.338 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.58 | 3.4 | -13.11 | 2 | 5 | 0 | 72 | 251.33 | 3 | ↓ |
