| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 22 | Yes |
Popular Name: (2S)-2-[(1-ethylimidazol-2-yl)methyl-methyl-amino]-2-(4-fluoro-3-methyl-phenyl)acetic (2S)-2-[(1-ethylimidazol-2-yl)me…
| 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) | 1.65 | 10.97 | -66.7 | 2 | 5 | 1 | 64 | 306.361 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.65 | 9.44 | -38.62 | 1 | 5 | 0 | 62 | 305.353 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.65 | 8.38 | -52.13 | 0 | 5 | -1 | 61 | 304.345 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.65 | 10.4 | -36.05 | 1 | 5 | 0 | 62 | 305.353 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
