In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 20 | Yes |
Popular Name: 2-[(2S)-pyrrolidin-2-yl]-5-[4-(trifluoromethyl)phenyl]-1H-imidazole 2-[(2S)-pyrrolidin-2-yl]-5-[4-(t…
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) | 2.75 | 6.76 | -40.41 | 3 | 3 | 1 | 45 | 282.289 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.75 | 5.59 | -6.94 | 2 | 3 | 0 | 41 | 281.281 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.75 | 7.18 | -115.87 | 4 | 3 | 2 | 47 | 283.297 | 3 | ↓ |