| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 8th, 2007 | 27 | 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) | 1.60 | 10.03 | -18.25 | 1 | 8 | 0 | 88 | 370.409 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.94 | 10.16 | -54.65 | 2 | 8 | 1 | 92 | 371.417 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.34 | 8.66 | -43.74 | 1 | 8 | -1 | 94 | 369.401 | 4 | ↓ |
