| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 28th, 2010 | 18 | Yes |
Popular Name: 6-[(S)-amino-(5-chloro-2-thienyl)methyl]-3H-1,3-benzoxazol-2-one 6-[(S)-amino-(5-chloro-2-thienyl…
| 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) | 2.82 | 3.5 | -61.57 | 4 | 4 | 1 | 74 | 281.744 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.27 | 0.54 | -46.78 | 2 | 4 | -1 | 75 | 279.728 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.82 | 3.17 | -9.6 | 3 | 4 | 0 | 72 | 280.736 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
