| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 6th, 2008 | 38 | 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) | 4.67 | 12.83 | -72.26 | 1 | 8 | 0 | 93 | 522.642 | 13 | ↓ |
| Hi High (pH 8-9.5) | 4.67 | 10.51 | -59.2 | 0 | 8 | -1 | 91 | 521.634 | 13 | ↓ |
| Mid Mid (pH 6-8) | 5.11 | 11.72 | -58.13 | 2 | 8 | 1 | 90 | 523.65 | 12 | ↓ |
| Mid Mid (pH 6-8) | 4.08 | 12.69 | -64.47 | 1 | 8 | 1 | 87 | 523.65 | 13 | ↓ |
