| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 28th, 2008 | 30 | 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) | 1.35 | 4.45 | -50.01 | 1 | 8 | -1 | 112 | 408.434 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.35 | 4.93 | -39.53 | 2 | 8 | 0 | 113 | 409.442 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.35 | 3.65 | -18.85 | 2 | 8 | 0 | 109 | 409.442 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.35 | 4.15 | -48.64 | 3 | 8 | 1 | 110 | 410.45 | 3 | ↓ |
