| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 12th, 2011 | 23 | 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) | 5.50 | 9.86 | -126.19 | 5 | 3 | 2 | 53 | 328.585 | 15 | ↓ |
| Hi High (pH 8-9.5) | 5.50 | 8.72 | -40.17 | 4 | 3 | 1 | 49 | 327.577 | 15 | ↓ |
| Mid Mid (pH 6-8) | 5.50 | 8.53 | -41.8 | 4 | 3 | 1 | 49 | 327.577 | 15 | ↓ |
