| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 19 | No |
Popular Name: 5-[[(3R)-1,1-dioxothian-3-yl]amino]-1,3-dimethyl-pyrazole-4-carboxylic 5-[[(3R)-1,1-dioxothian-3-yl]ami…
| 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) | -0.12 | 2.82 | -52.99 | 1 | 7 | -1 | 104 | 286.333 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.12 | 2.95 | -42.98 | 2 | 7 | 0 | 105 | 287.341 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
