| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 7th, 2006 | 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) | 2.85 | 8.76 | -59.51 | 0 | 6 | -1 | 83 | 419.482 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.85 | -1.03 | -13.55 | 1 | 6 | 0 | 79 | 420.49 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.85 | -0.92 | -38.85 | 2 | 6 | 1 | 80 | 421.498 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.26 | -1.16 | -22.96 | 0 | 6 | 0 | 76 | 420.49 | 7 | ↓ |
