| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 18th, 2009 | 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) | 2.17 | 6.25 | -41.16 | 3 | 7 | 1 | 73 | 392.568 | 10 | ↓ |
| Mid Mid (pH 6-8) | 2.17 | 6.11 | -79.05 | 4 | 7 | 2 | 74 | 393.576 | 10 | ↓ |
| Mid Mid (pH 6-8) | 2.17 | 7.93 | -108.89 | 4 | 7 | 2 | 74 | 393.576 | 10 | ↓ |
| Lo Low (pH 4.5-6) | 2.17 | 8.85 | -179.69 | 5 | 7 | 3 | 76 | 394.584 | 10 | ↓ |
