| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 13th, 2010 | 32 | 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) | 3.10 | 9.58 | -36.74 | 2 | 8 | 1 | 92 | 437.52 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.10 | 10.49 | -37.71 | 3 | 8 | 1 | 96 | 437.52 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.10 | 9.09 | -21.61 | 1 | 8 | 0 | 91 | 436.512 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 3.10 | 9.43 | -42.7 | 2 | 8 | 1 | 93 | 437.52 | 9 | ↓ |
