| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2009 | 29 | 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) | 3.04 | 8.31 | -44.04 | 2 | 6 | 1 | 53 | 399.511 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.04 | 5.78 | -8.93 | 1 | 6 | 0 | 52 | 398.503 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.04 | 9.6 | -131.63 | 3 | 6 | 2 | 58 | 400.519 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.04 | 7.13 | -50.65 | 2 | 6 | 1 | 57 | 399.511 | 8 | ↓ |
