| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 34 | 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) | 5.36 | 13.13 | -127.6 | 4 | 5 | 2 | 55 | 461.65 | 5 | ↓ |
| Hi High (pH 8-9.5) | 5.36 | 10.13 | -10.02 | 2 | 5 | 0 | 50 | 459.634 | 5 | ↓ |
| Mid Mid (pH 6-8) | 5.36 | 11.86 | -49.96 | 3 | 5 | 1 | 51 | 460.642 | 5 | ↓ |
