| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 17th, 2008 | 28 | 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) | 2.12 | 8.85 | -69.45 | 0 | 7 | -1 | 99 | 374.376 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.53 | 9.16 | -16.46 | 0 | 7 | 0 | 93 | 375.384 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.12 | 8.77 | -16.57 | 1 | 7 | 0 | 97 | 375.384 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.12 | 9.06 | -42.56 | 2 | 7 | 1 | 98 | 376.392 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.53 | 9.44 | -49.32 | 1 | 7 | 1 | 95 | 376.392 | 4 | ↓ |
