| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 12 | Yes |
| 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) | -0.88 | -0.79 | -102.08 | 6 | 3 | 2 | 59 | 173.304 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.88 | 0.93 | -27.19 | 5 | 3 | 1 | 56 | 172.296 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.88 | 1.11 | -115.13 | 6 | 3 | 2 | 58 | 173.304 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.88 | -0.5 | -40.6 | 5 | 3 | 1 | 57 | 172.296 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.88 | 1.32 | -103 | 6 | 3 | 2 | 58 | 173.304 | 4 | ↓ |
