| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 25th, 2008 | 29 | No |
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) | 3.23 | 7.71 | -25.13 | 1 | 6 | 0 | 70 | 394.471 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.23 | 5.37 | -47.01 | 0 | 6 | -1 | 69 | 393.463 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.23 | 7.8 | -48.27 | 1 | 6 | 0 | 70 | 394.471 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.23 | 7.2 | -43.49 | 2 | 6 | 1 | 67 | 395.479 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.23 | 7.08 | -47.14 | 2 | 6 | 1 | 67 | 395.479 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.23 | 4.86 | -10.09 | 1 | 6 | 0 | 66 | 394.471 | 4 | ↓ |
