| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 8th, 2006 | 32 | 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) | 4.66 | 13.26 | -11 | 2 | 7 | 0 | 85 | 487.361 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.83 | 13.12 | -41.05 | 1 | 7 | -1 | 86 | 486.353 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.83 | 13.62 | -32.9 | 3 | 7 | 1 | 90 | 488.369 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 4.66 | 13.52 | -45.1 | 3 | 7 | 1 | 86 | 488.369 | 4 | ↓ |
