| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2008 | 11 | 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) | 1.36 | 4.03 | -100.61 | 4 | 2 | 2 | 33 | 160.305 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.36 | 2.78 | -36.22 | 3 | 2 | 1 | 29 | 159.297 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.36 | 2.62 | -34.68 | 3 | 2 | 1 | 29 | 159.297 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
