| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 7th, 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) | 3.17 | 10.1 | -77 | 1 | 7 | 0 | 83 | 438.524 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.59 | 11.67 | -43.99 | 1 | 7 | 1 | 77 | 439.532 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.61 | 10.19 | -48.66 | 2 | 7 | 1 | 81 | 439.532 | 8 | ↓ |
