| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 25th, 2006 | 31 | 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) | 4.89 | 11.55 | -66.16 | 0 | 5 | -1 | 70 | 420.529 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.89 | 1.9 | -11.82 | 1 | 5 | 0 | 66 | 421.537 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.31 | 1.76 | -21.23 | 0 | 5 | 0 | 63 | 421.537 | 7 | ↓ |
