| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2008 | 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) | 2.64 | 7.06 | -58.57 | 0 | 9 | -1 | 105 | 491.52 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.64 | 9.41 | -69.29 | 1 | 9 | 0 | 106 | 492.528 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 2.64 | 8.45 | -47.5 | 2 | 9 | 1 | 103 | 493.536 | 8 | ↓ |
