In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 20 | Yes |
Popular Name: 5-(2,5-dimethoxyphenyl)-2-[(2S)-pyrrolidin-2-yl]-1H-imidazole 5-(2,5-dimethoxyphenyl)-2-[(2S)-…
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) | 1.89 | 4.44 | -38.08 | 3 | 5 | 1 | 64 | 274.344 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.89 | 3.55 | -9.88 | 2 | 5 | 0 | 59 | 273.336 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.89 | 4.85 | -104.25 | 4 | 5 | 2 | 65 | 275.352 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.