| 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 | -58.52 | 0 | 7 | -1 | 92 | 475.496 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.55 | 9.88 | -33.08 | 1 | 7 | 0 | 89 | 476.504 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.52 | 10.9 | -23.91 | 0 | 7 | 0 | 86 | 476.504 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 3.55 | 10.16 | -59.3 | 2 | 7 | 1 | 90 | 477.512 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 2.52 | 11.18 | -60.24 | 1 | 7 | 1 | 87 | 477.512 | 9 | ↓ |
