| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 18th, 2006 | 29 | 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) | 2.66 | 6 | -48.49 | 1 | 7 | -1 | 103 | 407.427 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.66 | -2.09 | -16.78 | 2 | 7 | 0 | 99 | 408.435 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.08 | -2.18 | -23.91 | 1 | 7 | 0 | 96 | 408.435 | 5 | ↓ |
