| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2008 | 31 | 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) | 1.31 | 7.5 | -20.02 | 2 | 10 | 0 | 123 | 437.485 | 4 | ↓ |
| Ref Reference (pH 7) | 1.13 | 9.12 | -19.42 | 2 | 10 | 0 | 120 | 437.485 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.31 | 7 | -50.95 | 1 | 10 | -1 | 122 | 436.477 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.13 | 8.61 | -45.54 | 1 | 10 | -1 | 118 | 436.477 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.13 | 9.04 | -18.99 | 2 | 10 | 0 | 120 | 437.485 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.31 | 7.48 | -18.35 | 2 | 10 | 0 | 123 | 437.485 | 4 | ↓ |
