| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 15th, 2007 | 34 | 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) | 4.66 | 8.6 | -15.64 | 2 | 7 | 0 | 88 | 455.514 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.64 | 9.2 | -60.36 | 0 | 7 | -1 | 87 | 454.506 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.64 | 9.24 | -53.56 | 0 | 7 | -1 | 87 | 454.506 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.66 | 9.55 | -40.21 | 1 | 7 | -1 | 91 | 454.506 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.66 | 9.37 | -54.55 | 1 | 7 | -1 | 91 | 454.506 | 7 | ↓ |
