| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 12th, 2010 | 27 | No |
| 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) | 4.87 | 4.9 | -45.38 | 1 | 6 | -1 | 95 | 540.131 | 2 | ↓ |
| Mid Mid (pH 6-8) | 4.87 | 5.67 | -98.16 | 0 | 6 | -2 | 98 | 539.123 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 4.41 | 7.32 | -10.37 | 2 | 6 | 0 | 92 | 541.139 | 2 | ↓ |
