In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2011 | 20 | Yes |
Popular Name: 3-isopropyl-7-[(5-methylpyrazin-2-yl)methyl]-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine 3-isopropyl-7-[(5-methylpyrazin-…
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) | 0.53 | 4.77 | -16.02 | 0 | 6 | 0 | 60 | 272.356 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.53 | 7.03 | -56.23 | 1 | 6 | 1 | 61 | 273.364 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.