| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 23rd, 2006 | 31 | 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) | 2.27 | 8.32 | -24.36 | 2 | 8 | 0 | 102 | 419.485 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.28 | 9.19 | -36.87 | 4 | 8 | 1 | 106 | 420.493 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.27 | 8.81 | -37.41 | 3 | 8 | 1 | 103 | 420.493 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.27 | 8.66 | -43.33 | 3 | 8 | 1 | 103 | 420.493 | 7 | ↓ |
