| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2004 | 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) | 5.12 | 13.42 | -51.75 | 0 | 6 | -1 | 93 | 429.448 | 9 | ↓ |
| Hi High (pH 8-9.5) | 6.32 | 13.28 | -93.7 | 0 | 6 | -2 | 99 | 428.44 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.93 | 13.49 | -29.42 | 0 | 6 | 0 | 87 | 430.456 | 10 | ↓ |
| Mid Mid (pH 6-8) | 5.12 | 13.35 | -55.08 | 0 | 6 | -1 | 93 | 429.448 | 9 | ↓ |
