| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2009 | 21 | Yes |
Popular Name: 4-(4-hydroxypyrimidin-2-yl)sulfanyl-2-(trifluoromethyl)benzamidine 4-(4-hydroxypyrimidin-2-yl)sulfa…
| 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) | 1.12 | 3.11 | -43.82 | 5 | 5 | 1 | 97 | 315.3 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.58 | 1.16 | -53.19 | 4 | 5 | 0 | 100 | 314.292 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.12 | 2.54 | -46.93 | 5 | 5 | 1 | 97 | 315.3 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
