| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 25th, 2008 | 33 | 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) | -5.09 | 8.3 | -78.8 | 6 | 8 | 2 | 111 | 462.635 | 12 | ↓ |
| Hi High (pH 8-9.5) | -5.09 | 9.09 | -70.88 | 5 | 8 | 1 | 114 | 461.627 | 12 | ↓ |
| Hi High (pH 8-9.5) | -5.09 | 8.99 | -67.01 | 5 | 8 | 1 | 114 | 461.627 | 12 | ↓ |
