| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2010 | 18 | Yes |
Popular Name: 2-[2-(methylamino)pyrimidin-5-yl]-1,3-benzothiazol-6-ol 2-[2-(methylamino)pyrimidin-5-yl…
None
| 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) | 2.61 | 3.44 | -8.42 | 2 | 5 | 0 | 71 | 258.306 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.61 | 4.21 | -41.45 | 1 | 5 | -1 | 74 | 257.298 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
