| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 25th, 2006 | 28 | 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) | 2.17 | 8.17 | -61.08 | 0 | 6 | -1 | 83 | 379.436 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.17 | -0.02 | -12.88 | 1 | 6 | 0 | 79 | 380.444 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.58 | -0.1 | -21.17 | 0 | 6 | 0 | 76 | 380.444 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.17 | 0.09 | -44.85 | 2 | 6 | 1 | 80 | 381.452 | 7 | ↓ |
