| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 23rd, 2009 | 22 | 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) | 1.76 | 5.92 | -14.22 | 3 | 6 | 0 | 74 | 300.41 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.50 | 5.29 | -27.36 | 4 | 6 | 1 | 77 | 301.418 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.76 | 8.21 | -47.64 | 4 | 6 | 1 | 75 | 301.418 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.76 | 6.4 | -23.83 | 4 | 6 | 1 | 75 | 301.418 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.43 | 6.08 | -90.3 | 4 | 6 | 2 | 73 | 302.426 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.76 | 6.38 | -23.47 | 4 | 6 | 1 | 75 | 301.418 | 2 | ↓ |
