| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 15 | 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) | 2.01 | 3.5 | -28.84 | 4 | 4 | 1 | 65 | 221.671 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.01 | 3.89 | -8.47 | 3 | 4 | 0 | 64 | 220.663 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.01 | 4.06 | -35.99 | 4 | 4 | 1 | 65 | 221.671 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
