| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 20 | No |
Popular Name: (3R)-N-[(4-methoxy-3,5-dimethyl-2-pyridyl)methyl]-1,1-dioxo-thian-3-amine (3R)-N-[(4-methoxy-3,5-dimethyl-…
| 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) | 1.32 | 2.39 | -55.85 | 2 | 5 | 1 | 73 | 299.416 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.32 | 1.71 | -42.02 | 2 | 5 | 1 | 70 | 299.416 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.32 | 1.2 | -13.75 | 1 | 5 | 0 | 68 | 298.408 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
