| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 15th, 2010 | 35 | 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) | 2.83 | 7.32 | -109.26 | 3 | 7 | 2 | 79 | 497.039 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.83 | 5.41 | -38.56 | 2 | 7 | 1 | 78 | 496.031 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.83 | 9.64 | -193.28 | 4 | 7 | 3 | 80 | 498.047 | 5 | ↓ |
