| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 2010 | 14 | Yes |
Popular Name: (3S)-3-amino-1-[(3-methylisoxazol-5-yl)methyl]pyrrolidin-2-one (3S)-3-amino-1-[(3-methylisoxazo…
| 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) | -1.00 | 1.25 | -57.33 | 3 | 5 | 1 | 74 | 196.23 | 2 | ↓ |
| Hi High (pH 8-9.5) | -1.00 | 0.93 | -15.85 | 2 | 5 | 0 | 72 | 195.222 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
