In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 3rd, 2010 | 21 | Yes |
Popular Name: (8R)-8-phenyl-3-(2-propoxyethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine (8R)-8-phenyl-3-(2-propoxyethyl)…
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) | 1.91 | 6.69 | -11.05 | 1 | 5 | 0 | 52 | 286.379 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.91 | 8.01 | -55.15 | 2 | 5 | 1 | 57 | 287.387 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.