| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 17 | No |
Popular Name: N2-(1,1-dioxothian-4-yl)-3-methyl-pyridine-2,5-diamine N2-(1,1-dioxothian-4-yl)-3-methy…
| 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) | 0.72 | 1.2 | -42.1 | 4 | 5 | 1 | 86 | 256.351 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.72 | 0.85 | -12.77 | 3 | 5 | 0 | 85 | 255.343 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
