| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 17 | No |
Popular Name: N3-[(3R)-1,1-dioxothian-3-yl]-2,5-dimethyl-pyrazole-3,4-diamine N3-[(3R)-1,1-dioxothian-3-yl]-2,…
| 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) | -0.21 | -0.03 | -14.96 | 3 | 6 | 0 | 90 | 258.347 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.21 | 0.1 | -37.11 | 4 | 6 | 1 | 91 | 259.355 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
