| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 29th, 2007 | 35 | 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) | 5.02 | 14.02 | -53.57 | 0 | 7 | -1 | 96 | 467.501 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.44 | 13.24 | -24.96 | 0 | 7 | 0 | 90 | 468.509 | 7 | ↓ |
| Mid Mid (pH 6-8) | 5.47 | 12.23 | -35.16 | 1 | 7 | 0 | 93 | 468.509 | 6 | ↓ |
