| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 3rd, 2010 | 38 | 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) | 0.82 | 9.58 | -127.92 | 4 | 9 | 2 | 96 | 522.694 | 7 | ↓ |
| Hi High (pH 8-9.5) | 0.82 | 6.51 | -74.14 | 3 | 9 | 1 | 95 | 521.686 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 0.82 | 10.05 | -178.74 | 5 | 9 | 3 | 97 | 523.702 | 7 | ↓ |
