| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 13th, 2008 | 28 | No |
Popular Name: 3-[(2S)-2-(4-bromophenyl)-3-(cyclopropanecarbonyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]benzoic 3-[(2S)-2-(4-bromophenyl)-3-(cyc…
| 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) | 3.66 | 11.2 | -129.46 | 0 | 6 | -2 | 101 | 440.249 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.08 | 10.2 | -78.23 | 0 | 6 | -1 | 95 | 441.257 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.66 | 8.87 | -86.22 | 1 | 6 | -1 | 98 | 441.257 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
