| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 27th, 2005 | 35 | 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) | 6.00 | 14.68 | -57.13 | 0 | 7 | -1 | 83 | 458.549 | 5 | ↓ |
| Mid Mid (pH 6-8) | 6.00 | 15.11 | -53.42 | 1 | 7 | 0 | 85 | 459.557 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 6.00 | 14.93 | -49.24 | 1 | 7 | 0 | 85 | 459.557 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 6.00 | 15.35 | -85.96 | 2 | 7 | 1 | 86 | 460.565 | 5 | ↓ |
