| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 7th, 2011 | 16 | No |
Popular Name: 1-(4-chlorophenyl)-4,4-dimethyl-5H-pyrimidin-1-ium-2-thiol 1-(4-chlorophenyl)-4,4-dimethyl-…
| 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) | 3.76 | 8.83 | -11.11 | 1 | 2 | 0 | 15 | 252.77 | 1 | ↓ |
| Mid Mid (pH 6-8) | 3.80 | 8.08 | -41.45 | 0 | 2 | -1 | 16 | 251.762 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
