| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2010 | 39 | 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) | 6.24 | 12.47 | -14.9 | 2 | 7 | 0 | 88 | 525.649 | 9 | ↓ |
| Ref Reference (pH 7) | 6.01 | 12.49 | -15.95 | 1 | 7 | 0 | 84 | 525.649 | 9 | ↓ |
| Hi High (pH 8-9.5) | 6.01 | 13.28 | -53.04 | 0 | 7 | -1 | 87 | 524.641 | 9 | ↓ |
| Hi High (pH 8-9.5) | 6.01 | 12.94 | -58.2 | 0 | 7 | -1 | 87 | 524.641 | 9 | ↓ |
| Hi High (pH 8-9.5) | 6.24 | 13.41 | -39.91 | 1 | 7 | -1 | 91 | 524.641 | 9 | ↓ |
