| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2009 | 32 | 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) | 3.07 | 6.43 | -58.67 | 0 | 7 | -1 | 82 | 500.369 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.07 | 8.71 | -70.02 | 1 | 7 | 0 | 83 | 501.377 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.07 | 7.95 | -52.49 | 2 | 7 | 1 | 81 | 502.385 | 7 | ↓ |
