| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 15th, 2007 | 31 | 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) | 4.17 | 9.18 | -14.09 | 2 | 6 | 0 | 78 | 437.565 | 8 | ↓ |
| Ref Reference (pH 7) | 4.17 | 9.31 | -14.41 | 2 | 6 | 0 | 78 | 437.565 | 8 | ↓ |
| Hi High (pH 8-9.5) | 4.15 | 9.42 | -58.77 | 0 | 6 | -1 | 77 | 436.557 | 8 | ↓ |
| Hi High (pH 8-9.5) | 4.15 | 9.64 | -46.05 | 0 | 6 | -1 | 77 | 436.557 | 8 | ↓ |
| Hi High (pH 8-9.5) | 4.17 | 10.09 | -45.55 | 1 | 6 | -1 | 81 | 436.557 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.17 | 9.94 | -54.02 | 1 | 6 | -1 | 81 | 436.557 | 8 | ↓ |
