| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 30th, 2007 | 32 | 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) | 5.10 | 11.17 | -48.82 | 1 | 5 | -1 | 78 | 429.54 | 7 | ↓ |
| Mid Mid (pH 6-8) | 5.10 | 0.11 | -41.55 | 3 | 5 | 1 | 76 | 431.556 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.52 | -0.1 | -36.34 | 2 | 5 | 1 | 73 | 431.556 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.56 | 11.98 | -13.15 | 2 | 5 | 0 | 71 | 430.548 | 7 | ↓ |
