In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 7th, 2010 | 19 | Yes |
Popular Name: (2R)-2-[4-[(1-ethylimidazol-2-yl)methyl]piperazin-1-yl]propanoic (2R)-2-[4-[(1-ethylimidazol-2-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) | -1.71 | 6.82 | -65.88 | 2 | 6 | 1 | 67 | 267.353 | 5 | ↓ |
Hi High (pH 8-9.5) | -1.71 | 6.41 | -38.19 | 1 | 6 | 0 | 66 | 266.345 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.