| 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-carbothioamide 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) | 0.11 | 1.25 | -22.75 | 3 | 6 | 0 | 90 | 302.425 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.11 | 1.38 | -48.88 | 4 | 6 | 1 | 91 | 303.433 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
