| 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 | 10.91 | -99.26 | 3 | 5 | 2 | 42 | 431.665 | 9 | ↓ |
| Hi High (pH 8-9.5) | 4.86 | 8.94 | -32.56 | 2 | 5 | 1 | 40 | 430.657 | 9 | ↓ |
| Hi High (pH 8-9.5) | 4.86 | 8.75 | -36.53 | 2 | 5 | 1 | 40 | 430.657 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.86 | 11.17 | -95.68 | 3 | 5 | 2 | 42 | 431.665 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 4.86 | 13.17 | -206.91 | 4 | 5 | 3 | 43 | 432.673 | 9 | ↓ |
