| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 19th, 2007 | 31 | 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) | -5.51 | -14.05 | -399.9 | 19 | 13 | 5 | 256 | 456.561 | 6 | ↓ |
| Hi High (pH 8-9.5) | -5.51 | -15.17 | -115.54 | 16 | 13 | 2 | 251 | 453.537 | 6 | ↓ |
| Hi High (pH 8-9.5) | -5.51 | -15.22 | -106.62 | 16 | 13 | 2 | 251 | 453.537 | 6 | ↓ |
| Mid Mid (pH 6-8) | -5.51 | -14.48 | -304.57 | 18 | 13 | 4 | 254 | 455.553 | 6 | ↓ |
| Mid Mid (pH 6-8) | -5.51 | -14.45 | -264.15 | 18 | 13 | 4 | 254 | 455.553 | 6 | ↓ |
