| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 29th, 2006 | 21 | 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) | 4.54 | 10.91 | -42.62 | 1 | 2 | 1 | 17 | 301.479 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.54 | 8.43 | -5.95 | 0 | 2 | 0 | 16 | 300.471 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 4.54 | 11.29 | -77.91 | 2 | 2 | 2 | 19 | 302.487 | 4 | ↓ |
