| 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 | -13.83 | -412.3 | 19 | 13 | 5 | 256 | 456.561 | 6 | ↓ |
| Hi High (pH 8-9.5) | -5.51 | -13.78 | -101.25 | 16 | 13 | 2 | 251 | 453.537 | 6 | ↓ |
| Hi High (pH 8-9.5) | -5.51 | -14.92 | -114.9 | 16 | 13 | 2 | 251 | 453.537 | 6 | ↓ |
| Mid Mid (pH 6-8) | -5.51 | -14.26 | -319.43 | 18 | 13 | 4 | 254 | 455.553 | 6 | ↓ |
| Mid Mid (pH 6-8) | -5.51 | -13 | -271.34 | 18 | 13 | 4 | 254 | 455.553 | 6 | ↓ |
