In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 25th, 2011 | 17 | Yes |
Popular Name: 5-methyl-3-[(3-methyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)methyl]isoxazole 5-methyl-3-[(3-methyl-6,8-dihydr…
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) | -0.34 | 6.65 | -58.49 | 1 | 6 | 1 | 61 | 234.283 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.34 | 4.38 | -18.97 | 0 | 6 | 0 | 60 | 233.275 | 2 | ↓ |