| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 13th, 2010 | 36 | 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) | 3.79 | 8.61 | -75.36 | 0 | 9 | -1 | 114 | 485.472 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.79 | 9.04 | -56.5 | 1 | 9 | 0 | 115 | 486.48 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.79 | 7.86 | -20.24 | 1 | 9 | 0 | 111 | 486.48 | 7 | ↓ |
