| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 2009 | 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) | 4.01 | 8.96 | -59.43 | 0 | 7 | -1 | 86 | 502.616 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.01 | 11.78 | -70.56 | 1 | 7 | 0 | 87 | 503.624 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 4.01 | 10.96 | -53.07 | 2 | 7 | 1 | 84 | 504.632 | 7 | ↓ |
