| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 14th, 2010 | 26 | 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) | 2.00 | 4.81 | -43.54 | 2 | 7 | -1 | 103 | 406.49 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.75 | 3.43 | -89.64 | 1 | 7 | -2 | 106 | 405.482 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.75 | 3.48 | -105.33 | 1 | 7 | -2 | 106 | 405.482 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.75 | 3.55 | -105.84 | 1 | 7 | -2 | 106 | 405.482 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.75 | 3.35 | -89.15 | 1 | 7 | -2 | 106 | 405.482 | 3 | ↓ |
