| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2010 | 21 | Yes |
Popular Name: 6-[(1S)-1-amino-2-(2,5-dimethylphenyl)ethyl]-3H-1,3-benzoxazol-2-one 6-[(1S)-1-amino-2-(2,5-dimethylp…
| 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) | 1.27 | 5.7 | -61.51 | 4 | 4 | 1 | 74 | 283.351 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.73 | 3.27 | -48.12 | 2 | 4 | -1 | 75 | 281.335 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.27 | 5.9 | -10.58 | 3 | 4 | 0 | 72 | 282.343 | 3 | ↓ |
