| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2009 | 28 | 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) | 1.82 | 4.52 | -43.73 | 3 | 7 | 1 | 91 | 385.44 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.82 | 2.83 | -49.21 | 1 | 7 | -1 | 93 | 383.424 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.82 | 2.26 | -12.39 | 2 | 7 | 0 | 90 | 384.432 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.82 | 5.09 | -33.41 | 2 | 7 | 0 | 94 | 384.432 | 5 | ↓ |
