| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 29th, 2008 | 29 | No |
| 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) | 2.09 | 14.66 | -27.47 | 0 | 7 | 0 | 80 | 385.427 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.09 | 15.38 | -63.92 | 0 | 7 | -1 | 82 | 384.419 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.09 | 15.87 | -28.58 | 2 | 7 | 1 | 85 | 386.435 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.09 | 14.98 | -42.31 | 1 | 7 | 1 | 82 | 386.435 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.09 | 15.14 | -29.83 | 1 | 7 | 1 | 82 | 386.435 | 3 | ↓ |
