| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 14 | 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) | 1.91 | 4.01 | -38.85 | 2 | 2 | 1 | 20 | 197.346 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.91 | 5.9 | -98.35 | 3 | 2 | 2 | 21 | 198.354 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.91 | 4.54 | -28.36 | 2 | 2 | 1 | 16 | 197.346 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
