| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 13th, 2010 | 36 | 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) | 3.00 | 8.51 | -22.7 | 2 | 8 | 0 | 112 | 518.62 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.46 | 6.49 | -61.09 | 1 | 8 | -1 | 115 | 517.612 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.00 | 9.01 | -60.3 | 3 | 8 | 1 | 113 | 519.628 | 4 | ↓ |
