| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 6th, 2007 | 31 | 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) | 1.97 | 6.34 | -64.64 | 0 | 8 | -1 | 105 | 421.429 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.39 | -1.39 | -23.32 | 0 | 8 | 0 | 98 | 422.437 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 1.97 | -1.1 | -41.91 | 2 | 8 | 1 | 103 | 423.445 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 1.39 | -1.27 | -51.36 | 1 | 8 | 1 | 100 | 423.445 | 8 | ↓ |
