| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 8th, 2007 | 36 | 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) | 5.53 | 13.82 | -53.14 | 0 | 8 | -1 | 119 | 502.503 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.95 | 14.02 | -17.22 | 0 | 8 | 0 | 113 | 503.511 | 5 | ↓ |
| Mid Mid (pH 6-8) | 5.98 | 13.66 | -23.26 | 1 | 8 | 0 | 116 | 503.511 | 4 | ↓ |
