| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2010 | 37 | 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) | 6.95 | 12.58 | -15.44 | 2 | 7 | 0 | 88 | 505.659 | 12 | ↓ |
| Hi High (pH 8-9.5) | 6.72 | 12.92 | -51.3 | 0 | 7 | -1 | 87 | 504.651 | 12 | ↓ |
| Hi High (pH 8-9.5) | 6.72 | 13.16 | -58.7 | 0 | 7 | -1 | 87 | 504.651 | 12 | ↓ |
| Hi High (pH 8-9.5) | 6.95 | 13.53 | -40.59 | 1 | 7 | -1 | 91 | 504.651 | 12 | ↓ |
