| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 6th, 2008 | 35 | 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) | 3.10 | 10.93 | -58.85 | 0 | 7 | -1 | 92 | 475.496 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.55 | 8.96 | -31.23 | 1 | 7 | 0 | 89 | 476.504 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.52 | 9.98 | -24.39 | 0 | 7 | 0 | 86 | 476.504 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 3.55 | 9.24 | -54.73 | 2 | 7 | 1 | 90 | 477.512 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 2.52 | 10.26 | -53.86 | 1 | 7 | 1 | 87 | 477.512 | 9 | ↓ |
