In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 3rd, 2011 | 18 | Yes |
Popular Name: 2-(1,3-benzodioxol-5-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine 2-(1,3-benzodioxol-5-yl)-5,6,7,8…
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) | 1.08 | 3.74 | -33.1 | 2 | 5 | 1 | 50 | 244.274 | 1 | ↓ |
Hi High (pH 8-9.5) | 1.08 | 3.32 | -12.88 | 1 | 5 | 0 | 48 | 243.266 | 1 | ↓ |
Lo Low (pH 4.5-6) | 1.08 | 4.65 | -56.4 | 2 | 5 | 1 | 53 | 244.274 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.