| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 29th, 2006 | 29 | 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) | 3.06 | 8.77 | -17.05 | 1 | 7 | 0 | 82 | 392.459 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.07 | 9.83 | -29.67 | 3 | 7 | 1 | 86 | 393.467 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.06 | 9.26 | -29.82 | 2 | 7 | 1 | 83 | 393.467 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.06 | 9.1 | -36.26 | 2 | 7 | 1 | 83 | 393.467 | 7 | ↓ |
