| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 29th, 2007 | 21 | No |
Popular Name: benzo[1,3]dioxol-5-ylmethylamino-(2-fluorophenyl)imino-methanethiol benzo[1,3]dioxol-5-ylmethylamino…
| 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) | 2.75 | 6.95 | -11.74 | 2 | 4 | 0 | 43 | 304.346 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.43 | 6.64 | -41.65 | 1 | 4 | -1 | 43 | 303.338 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.43 | 7.13 | -44.65 | 1 | 4 | -1 | 43 | 303.338 | 4 | ↓ |
