In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 12th, 2011 | 15 | Yes |
Popular Name: (8R)-8-methyl-3-(1H-pyrazol-5-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine (8R)-8-methyl-3-(1H-pyrazol-5-yl…
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) | -0.08 | 2.81 | -57.02 | 3 | 6 | 1 | 76 | 205.245 | 1 | ↓ |
Mid Mid (pH 6-8) | -0.08 | 1.65 | -13.25 | 2 | 6 | 0 | 71 | 204.237 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.