| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 16th, 2010 | 37 | 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) | 4.60 | 14.62 | -54.83 | 1 | 7 | 1 | 55 | 506.715 | 11 | ↓ |
| Hi High (pH 8-9.5) | 4.60 | 12.54 | -12.3 | 0 | 7 | 0 | 54 | 505.707 | 11 | ↓ |
| Mid Mid (pH 6-8) | 4.60 | 14.5 | -58.78 | 1 | 7 | 1 | 55 | 506.715 | 11 | ↓ |
| Lo Low (pH 4.5-6) | 4.60 | 15.33 | -77.95 | 2 | 7 | 2 | 56 | 507.723 | 11 | ↓ |
