| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 6th, 2008 | 37 | No |
None
| 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) | 3.63 | 10.03 | -17.75 | 1 | 8 | 0 | 98 | 502.567 | 11 | ↓ |
| Mid Mid (pH 6-8) | 3.05 | 10.68 | -25.65 | 0 | 8 | 0 | 95 | 502.567 | 11 | ↓ |
| Lo Low (pH 4.5-6) | 4.07 | 9.99 | -64.16 | 2 | 8 | 1 | 99 | 503.575 | 10 | ↓ |
| Lo Low (pH 4.5-6) | 3.05 | 10.96 | -67.7 | 1 | 8 | 1 | 96 | 503.575 | 11 | ↓ |
