In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 3rd, 2010 | 15 | Yes |
Popular Name: 3-(2-propoxyethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine 3-(2-propoxyethyl)-5,6,7,8-tetra…
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) | 0.13 | 4.39 | -56.82 | 2 | 5 | 1 | 57 | 211.289 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.13 | 3.02 | -10.03 | 1 | 5 | 0 | 52 | 210.281 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.