| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2009 | 30 | No |
| 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) | 2.99 | 6.93 | -11.9 | 0 | 6 | 0 | 65 | 400.434 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.99 | 9.78 | -52.16 | 1 | 6 | 1 | 66 | 401.442 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.99 | 10.26 | -89.3 | 2 | 6 | 2 | 67 | 402.45 | 4 | ↓ |
