| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 19 | No |
Popular Name: 3-[[(3S)-1,1-dioxothian-3-yl]amino]-5,6-dimethyl-pyridazine-4-carbonitrile 3-[[(3S)-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) | 0.68 | 2.49 | -15.59 | 1 | 6 | 0 | 96 | 280.353 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.68 | 2.61 | -44.23 | 2 | 6 | 1 | 97 | 281.361 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
