| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 18th, 2008 | 26 | 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) | -4.38 | -5.48 | -337.51 | 15 | 8 | 5 | 146 | 379.662 | 21 | ↓ |
| Hi High (pH 8-9.5) | -4.38 | -5.89 | -240.04 | 14 | 8 | 4 | 144 | 378.654 | 21 | ↓ |
| Mid Mid (pH 6-8) | -4.38 | -4.47 | -361.72 | 15 | 8 | 5 | 149 | 379.662 | 21 | ↓ |
| Mid Mid (pH 6-8) | -4.38 | -4.15 | -469.48 | 16 | 8 | 6 | 150 | 380.67 | 21 | ↓ |
| Lo Low (pH 4.5-6) | -4.38 | -2.03 | -644.85 | 17 | 8 | 7 | 151 | 381.678 | 21 | ↓ |
