| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 5th, 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) | 2.91 | 8.14 | -25.65 | 1 | 6 | 0 | 77 | 327.384 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.91 | 7.35 | -48.59 | 2 | 6 | 1 | 74 | 328.392 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.91 | 8.06 | -46.94 | 1 | 6 | 0 | 77 | 327.384 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.91 | 7.28 | -47.45 | 2 | 6 | 1 | 74 | 328.392 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.91 | 5.68 | -33.77 | 0 | 6 | -1 | 75 | 326.376 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.91 | 4.9 | -12.02 | 1 | 6 | 0 | 73 | 327.384 | 5 | ↓ |
