| 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 | 13.12 | -72.21 | 1 | 8 | 0 | 93 | 522.642 | 13 | ↓ |
| Hi High (pH 8-9.5) | 4.67 | 10.87 | -59.01 | 0 | 8 | -1 | 91 | 521.634 | 13 | ↓ |
| Mid Mid (pH 6-8) | 5.11 | 12.07 | -59.29 | 2 | 8 | 1 | 90 | 523.65 | 12 | ↓ |
| Mid Mid (pH 6-8) | 4.08 | 13.09 | -62.76 | 1 | 8 | 1 | 87 | 523.65 | 13 | ↓ |
