| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2009 | 39 | 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) | 4.73 | 12.16 | -63.25 | 0 | 7 | -1 | 82 | 525.625 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.73 | 14.42 | -76.18 | 1 | 7 | 0 | 83 | 526.633 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 4.73 | 13.53 | -53.75 | 2 | 7 | 1 | 81 | 527.641 | 9 | ↓ |
