| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 7th, 2006 | 32 | 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) | 2.04 | 6.12 | -61.04 | 1 | 7 | -1 | 103 | 433.415 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.49 | -0.51 | -24.41 | 2 | 7 | 0 | 99 | 434.423 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.49 | -0.4 | -52.71 | 3 | 7 | 1 | 101 | 435.431 | 5 | ↓ |
