| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 24th, 2008 | 18 | 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) | 1.77 | 3.62 | -7.54 | 2 | 8 | 0 | 110 | 253.262 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.77 | 3.92 | -36.83 | 3 | 8 | 1 | 111 | 254.27 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.77 | 4.41 | -32.12 | 3 | 8 | 1 | 111 | 254.27 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
