| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 29th, 2008 | 29 | 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) | 1.43 | 6.58 | -14.58 | 2 | 10 | 0 | 116 | 393.407 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.62 | 6.24 | -42.78 | 1 | 10 | -1 | 122 | 392.399 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.80 | 5.8 | -42.07 | 2 | 10 | 0 | 127 | 393.407 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.61 | 6.71 | -32.52 | 3 | 10 | 1 | 121 | 394.415 | 5 | ↓ |
