| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 30th, 2008 | 31 | Yes |
None
| 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) | 4.86 | 10.57 | -101.34 | 3 | 5 | 2 | 42 | 431.665 | 9 | ↓ |
| Hi High (pH 8-9.5) | 4.86 | 8.82 | -30.06 | 2 | 5 | 1 | 40 | 430.657 | 9 | ↓ |
| Hi High (pH 8-9.5) | 4.86 | 8.4 | -35.42 | 2 | 5 | 1 | 40 | 430.657 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.86 | 11.41 | -86.29 | 3 | 5 | 2 | 42 | 431.665 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 4.86 | 12.8 | -193.76 | 4 | 5 | 3 | 43 | 432.673 | 9 | ↓ |
