| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 21st, 2009 | 29 | Yes |
Popular Name: N-[2-[[4-(azepan-1-ylmethyl)thiazol-2-yl]amino]-2-oxo-ethyl]-1,3-benzodioxole-5-carboxamide N-[2-[[4-(azepan-1-ylmethyl)thia…
| 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) | 2.70 | 6.12 | -45.65 | 3 | 8 | 1 | 94 | 417.511 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.52 | 5.05 | -40.51 | 2 | 8 | 0 | 100 | 416.503 | 6 | ↓ |
