| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 2nd, 2011 | 17 | Yes |
Popular Name: 6-[(2S)-pyrrolidine-2-carbonyl]-3H-1,3-benzoxazol-2-one 6-[(2S)-pyrrolidine-2-carbonyl]-…
| 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) | 0.85 | 2.69 | -52.29 | 3 | 5 | 1 | 80 | 233.247 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.31 | -1.12 | -49.84 | 1 | 5 | -1 | 78 | 231.231 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.85 | 1.51 | -16.14 | 2 | 5 | 0 | 75 | 232.239 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
