| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 24th, 2008 | 19 | 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) | 0.21 | 6.45 | -102.59 | 4 | 3 | 2 | 35 | 261.413 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.21 | 3.88 | -1.76 | 2 | 3 | 0 | 32 | 259.397 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.21 | 4.12 | -40.42 | 3 | 3 | 1 | 34 | 260.405 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.21 | 6.14 | -33.14 | 3 | 3 | 1 | 34 | 260.405 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.21 | 6.2 | -127.87 | 4 | 3 | 2 | 35 | 261.413 | 3 | ↓ |
