| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 19 | 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) | 1.23 | 5.12 | -94.01 | 4 | 4 | 2 | 44 | 273.465 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.23 | 1.97 | -40.28 | 3 | 4 | 1 | 43 | 272.457 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.23 | 4.52 | -29.86 | 3 | 4 | 1 | 43 | 272.457 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.23 | 2.82 | -24.71 | 3 | 4 | 1 | 43 | 272.457 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.23 | 1.28 | -1.19 | 2 | 4 | 0 | 42 | 271.449 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 1.23 | 4.86 | -106.26 | 4 | 4 | 2 | 45 | 273.465 | 8 | ↓ |
