| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 27th, 2007 | 32 | 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) | 2.95 | 10.09 | -58.29 | 0 | 7 | -1 | 92 | 430.436 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.36 | 9.12 | -22.01 | 0 | 7 | 0 | 86 | 431.444 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.39 | 8.09 | -28.75 | 1 | 7 | 0 | 89 | 431.444 | 5 | ↓ |
