| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 26th, 2011 | 18 | 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) | 1.82 | 3.99 | -50.29 | 3 | 4 | 1 | 51 | 256.414 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.82 | 3.6 | -7.41 | 2 | 4 | 0 | 50 | 255.406 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 1.82 | 6.19 | -127.41 | 4 | 4 | 2 | 52 | 257.422 | 8 | ↓ |
