| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 19 | Yes |
Popular Name: (3S)-3-amino-4-[(2R)-2-(3-methylisoxazol-5-yl)pyrrolidin-1-yl]-4-oxo-butanamide (3S)-3-amino-4-[(2R)-2-(3-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) | -0.32 | -0.72 | -43.16 | 5 | 7 | 1 | 117 | 267.309 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.32 | -1.06 | -19.36 | 4 | 7 | 0 | 115 | 266.301 | 4 | ↓ |
