| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 19th, 2004 | 31 | 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) | 4.18 | 11.9 | -47.82 | 0 | 6 | -1 | 86 | 436.488 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.63 | 1.23 | -25.75 | 1 | 6 | 0 | 83 | 437.496 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.60 | 1.45 | -15.12 | 0 | 6 | 0 | 80 | 437.496 | 5 | ↓ |
