| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 21 | Yes |
Popular Name: (3R)-3-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]-3-phenyl-propanenitrile (3R)-3-[(4-oxo-6-propyl-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) | 3.95 | 7.17 | -49.91 | 0 | 4 | -1 | 73 | 298.391 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.49 | 8.51 | -20.68 | 1 | 4 | 0 | 70 | 299.399 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
