| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 30th, 2007 | 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) | 6.07 | 11.23 | -15.16 | 2 | 7 | 0 | 88 | 518.013 | 8 | ↓ |
| Ref Reference (pH 7) | 6.07 | 10.88 | -13.01 | 2 | 7 | 0 | 88 | 518.013 | 8 | ↓ |
| Hi High (pH 8-9.5) | 6.05 | 11.47 | -42.91 | 0 | 7 | -1 | 87 | 517.005 | 8 | ↓ |
| Hi High (pH 8-9.5) | 6.05 | 11.23 | -53.87 | 0 | 7 | -1 | 87 | 517.005 | 8 | ↓ |
| Hi High (pH 8-9.5) | 6.07 | 11.99 | -38.14 | 1 | 7 | -1 | 91 | 517.005 | 8 | ↓ |
| Mid Mid (pH 6-8) | 6.07 | 11.65 | -48.99 | 1 | 7 | -1 | 91 | 517.005 | 8 | ↓ |
