| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 9th, 2004 | 26 | 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) | 3.47 | 4.36 | -48.2 | 1 | 6 | -1 | 94 | 387.462 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.47 | 4.4 | -107.23 | 0 | 6 | -2 | 96 | 386.454 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.47 | 4.37 | -48.57 | 1 | 6 | -1 | 94 | 387.462 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.47 | 4.32 | -15.17 | 2 | 6 | 0 | 92 | 388.47 | 6 | ↓ |
