| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 13th, 2008 | 30 | No |
Popular Name: 3-[(2S)-2-(4-carboxyphenyl)-3-(cyclopropanecarbonyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]benzoic 3-[(2S)-2-(4-carboxyphenyl)-3-(c…
| 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) | 2.77 | 11.14 | -188.59 | 0 | 8 | -3 | 141 | 404.354 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.18 | 9.2 | -125.73 | 0 | 8 | -2 | 135 | 405.362 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.77 | 7.87 | -135.3 | 1 | 8 | -2 | 138 | 405.362 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
