| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 20 | No |
Popular Name: N3-[(3R)-1,1-dioxothian-3-yl]-2-methoxy-N4,N4-dimethyl-pyridine-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) | 1.39 | 1.97 | -39.06 | 2 | 6 | 1 | 73 | 300.404 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.39 | 1.08 | -13.08 | 1 | 6 | 0 | 72 | 299.396 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
