In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 20 | Yes |
Popular Name: 5-(4-tert-butylphenyl)-2-[(2S)-pyrrolidin-2-yl]-1H-imidazole 5-(4-tert-butylphenyl)-2-[(2S)-p…
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) | 3.56 | 8.08 | -36.88 | 3 | 3 | 1 | 45 | 270.4 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.56 | 6.91 | -6.95 | 2 | 3 | 0 | 41 | 269.392 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.56 | 8.49 | -107.51 | 4 | 3 | 2 | 47 | 271.408 | 3 | ↓ |