| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2009 | 19 | Yes |
Popular Name: 6-[(S)-methylamino-(3-methyl-2-thienyl)methyl]-3H-1,3-benzoxazol-2-one 6-[(S)-methylamino-(3-methyl-2-t…
| 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) | 2.77 | 5.12 | -50.28 | 3 | 4 | 1 | 63 | 275.353 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.22 | 1.38 | -47.14 | 1 | 4 | -1 | 61 | 273.337 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.22 | 2.5 | -69.41 | 2 | 4 | 0 | 66 | 274.345 | 3 | ↓ |
