| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 22nd, 2007 | 37 | 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) | 3.21 | 10.21 | -71.09 | 1 | 9 | 0 | 102 | 512.603 | 11 | ↓ |
| Hi High (pH 8-9.5) | 3.21 | 7.67 | -58.91 | 0 | 9 | -1 | 101 | 511.595 | 11 | ↓ |
| Mid Mid (pH 6-8) | 2.63 | 2.34 | -51.41 | 1 | 9 | 1 | 95 | 513.611 | 11 | ↓ |
