| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 18th, 2009 | 30 | 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) | 4.28 | 8.43 | -14.36 | 2 | 6 | 0 | 90 | 406.53 | 13 | ↓ |
| Mid Mid (pH 6-8) | 4.28 | 9.51 | -58.76 | 3 | 6 | 1 | 95 | 407.538 | 13 | ↓ |
| Lo Low (pH 4.5-6) | 4.28 | 10.59 | -118.37 | 4 | 6 | 2 | 99 | 408.546 | 13 | ↓ |
