| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2008 | 16 | Yes |
| 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) | -0.01 | 2.43 | -44.9 | 3 | 3 | 1 | 40 | 221.324 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.01 | 2.09 | -3.92 | 2 | 3 | 0 | 38 | 220.316 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.01 | 4.34 | -36.49 | 3 | 3 | 1 | 40 | 221.324 | 2 | ↓ |
| Lo Low (pH 4.5-6) | -0.01 | 4.66 | -127.85 | 4 | 3 | 2 | 41 | 222.332 | 2 | ↓ |
