In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2008 | 16 | Yes |
Popular Name: (2R)-2-(2-methylimidazol-1-yl)-1-piperazin-1-yl-propan-1-one (2R)-2-(2-methylimidazol-1-yl)-1…
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) | -0.91 | 3.12 | -34.2 | 2 | 5 | 1 | 51 | 223.3 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.91 | 4.06 | -61.6 | 2 | 5 | 1 | 55 | 223.3 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.91 | 4.49 | -94.61 | 3 | 5 | 2 | 56 | 224.308 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.91 | 2.69 | -13.54 | 1 | 5 | 0 | 50 | 222.292 | 2 | ↓ |