| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 25th, 2004 | 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) | 5.08 | 13.56 | -53.6 | 0 | 6 | -1 | 79 | 502.974 | 8 | ↓ |
| Mid Mid (pH 6-8) | 5.53 | -1.49 | -30.86 | 1 | 6 | 0 | 76 | 503.982 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.50 | -1.23 | -25.46 | 0 | 6 | 0 | 72 | 503.982 | 8 | ↓ |
