| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 22nd, 2008 | 27 | 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) | 1.25 | 4.87 | -42.89 | 2 | 7 | 1 | 60 | 382.573 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.25 | 4.77 | -39.91 | 2 | 7 | 1 | 60 | 382.573 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.25 | 2.72 | -12.49 | 1 | 7 | 0 | 59 | 381.565 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.25 | 7.14 | -92.07 | 3 | 7 | 2 | 62 | 383.581 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.25 | 7.03 | -99.37 | 3 | 7 | 2 | 62 | 383.581 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.25 | 8.9 | -184.64 | 4 | 7 | 3 | 63 | 384.589 | 6 | ↓ |
