| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 23rd, 2009 | 18 | No |
Popular Name: 3-(1-methylpyrazol-3-yl)-2-thioxo-1H-quinazolin-4-one 3-(1-methylpyrazol-3-yl)-2-thiox…
| 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) | 1.31 | 6.68 | -21.86 | 1 | 5 | 0 | 56 | 258.306 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.04 | 6.25 | -53.15 | 0 | 5 | -1 | 53 | 257.298 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
