| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 18th, 2006 | 22 | 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) | 3.82 | 8.14 | -34.03 | 4 | 5 | 1 | 67 | 333.202 | 1 | ↓ |
| Mid Mid (pH 6-8) | 3.69 | 9.26 | -15.73 | 3 | 5 | 0 | 68 | 332.194 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 3.82 | 10.83 | -27.93 | 4 | 5 | 1 | 67 | 333.202 | 1 | ↓ |
