In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 10th, 2011 | 26 | Yes |
Popular Name: 1-[4-(5-isopropyl-[1,2,4]triazolo[4,3-a]pyrimidin-7-yl)piperazin-1-yl]-2-(3-thienyl)ethanone 1-[4-(5-isopropyl-[1,2,4]triazol…
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) | 2.17 | 12.61 | -26.3 | 0 | 7 | 0 | 67 | 370.482 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.