| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 20th, 2010 | 23 | Yes |
Popular Name: 3-(4-fluorophenyl)-7-(4-methylpiperazin-1-yl)isothiazolo[4,5-d]pyrimidine 3-(4-fluorophenyl)-7-(4-methylpi…
| 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) | 2.72 | 9.53 | -45.86 | 1 | 5 | 1 | 46 | 330.412 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.72 | 7.17 | -5.83 | 0 | 5 | 0 | 45 | 329.404 | 2 | ↓ |
