| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2008 | 24 | 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) | 1.64 | 10.16 | -261.51 | 0 | 6 | -3 | 120 | 333.36 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.64 | 9.25 | -151.34 | 1 | 6 | -2 | 118 | 334.368 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.64 | 9.01 | -156.75 | 1 | 6 | -2 | 118 | 334.368 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.47 | 10.56 | -77.45 | 0 | 6 | -1 | 108 | 335.376 | 3 | ↓ |
