| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2009 | 17 | No |
Popular Name: 3-[(1S)-3-(2-carboxyethyl)-4-oxo-cyclohex-2-en-1-yl]propanoic 3-[(1S)-3-(2-carboxyethyl)-4-oxo…
| 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) | 0.29 | 7.87 | -104.87 | 0 | 5 | -2 | 97 | 238.239 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 0.29 | 5.9 | -58.19 | 1 | 5 | -1 | 94 | 239.247 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 0.29 | 5.89 | -57.22 | 1 | 5 | -1 | 94 | 239.247 | 6 | ↓ |
