| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 10th, 2006 | 28 | 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) | 2.91 | 9.44 | -138.53 | 0 | 7 | -2 | 116 | 378.336 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.91 | 8.6 | -68.4 | 1 | 7 | -1 | 113 | 379.344 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.91 | 7.13 | -23.94 | 2 | 7 | 0 | 110 | 380.352 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.91 | 9.19 | -143.77 | 0 | 7 | -2 | 116 | 378.336 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.91 | 8 | -23 | 2 | 7 | 0 | 110 | 380.352 | 4 | ↓ |
