| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2004 | 26 | No |
Popular Name: 3-[[2-methyl-2-(4-nitropyrazol-1-yl)propanoyl]amino]-2-thioxo-quinazolin-4-olate 3-[[2-methyl-2-(4-nitropyrazol-1…
| 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) | 1.35 | 6.3 | -54.62 | 1 | 10 | -1 | 134 | 373.374 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.89 | 7.69 | -28.99 | 2 | 10 | 0 | 131 | 374.382 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
