| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 29th, 2008 | 26 | No |
| 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) | 5.13 | 7.83 | -12.55 | 2 | 7 | 0 | 111 | 369.402 | 3 | ↓ |
| Ref Reference (pH 7) | 5.13 | 8.25 | -12.99 | 2 | 7 | 0 | 111 | 369.402 | 3 | ↓ |
| Hi High (pH 8-9.5) | 5.59 | 7 | -91.47 | 0 | 7 | -2 | 117 | 367.386 | 3 | ↓ |
| Hi High (pH 8-9.5) | 5.59 | 6.32 | -91.13 | 0 | 7 | -2 | 117 | 367.386 | 3 | ↓ |
| Mid Mid (pH 6-8) | 5.13 | 9.23 | -42.52 | 1 | 7 | -1 | 114 | 368.394 | 3 | ↓ |
| Mid Mid (pH 6-8) | 5.13 | 8.82 | -42.26 | 1 | 7 | -1 | 114 | 368.394 | 3 | ↓ |
