| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2009 | 21 | Yes |
Popular Name: 6-[(1R)-1-amino-2-(2-chloro-6-fluoro-phenyl)ethyl]-3H-1,3-benzoxazol-2-one 6-[(1R)-1-amino-2-(2-chloro-6-fl…
| 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) | 1.19 | 5.18 | -51.28 | 4 | 4 | 1 | 74 | 307.732 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.65 | 2.23 | -49.41 | 2 | 4 | -1 | 75 | 305.716 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.65 | 2.56 | -71.31 | 3 | 4 | 0 | 77 | 306.724 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
