| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 22nd, 2006 | 25 | Yes |
| 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) | 2.11 | 3.54 | -15.68 | 3 | 6 | 0 | 89 | 335.363 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.09 | 3.76 | -48.29 | 1 | 6 | -1 | 88 | 334.355 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.09 | 3.54 | -59.77 | 1 | 6 | -1 | 88 | 334.355 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.11 | 4.32 | -41.57 | 2 | 6 | -1 | 92 | 334.355 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.11 | 3.94 | -56.43 | 2 | 6 | -1 | 92 | 334.355 | 4 | ↓ |
