| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 6th, 2006 | 29 | 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) | 3.55 | 3.28 | -14.51 | 3 | 6 | 0 | 88 | 408.376 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.18 | 3.71 | -33.57 | 3 | 6 | 0 | 96 | 408.376 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.18 | 2.9 | -45.89 | 4 | 6 | 1 | 93 | 409.384 | 5 | ↓ |
