| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 19 | Yes |
Popular Name: (3R)-3-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-3-phenyl-propanenitrile (3R)-3-[(6-methyl-4-oxo-1H-pyrim…
| 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) | 2.87 | 5.61 | -49.84 | 0 | 4 | -1 | 73 | 270.337 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.41 | 6.98 | -21.98 | 1 | 4 | 0 | 70 | 271.345 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
