| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 12th, 2004 | 24 | No |
Popular Name: 4-nitro-N-{6-nitro-1,3-benzothiazol-2-yl}-1-methyl-1H-pyrazole-3-carboxamide 4-nitro-N-{6-nitro-1,3-benzothia…
| 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) | 1.90 | 7.71 | -20.46 | 1 | 11 | 0 | 151 | 348.3 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.96 | 6.09 | -50.18 | 0 | 11 | -1 | 158 | 347.292 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
