In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 5th, 2011 | 18 | Yes |
Popular Name: 2-(7-ethyl-5-isopropyl-3-oxo-[1,2,4]triazolo[3,4-f]pyrimidin-2-yl)acetonitrile 2-(7-ethyl-5-isopropyl-3-oxo-[1,…
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) | 1.30 | 7.66 | -11.1 | 0 | 6 | 0 | 76 | 245.286 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.