| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 15th, 2011 | 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) | -0.05 | 6.3 | -55.51 | 3 | 3 | 1 | 45 | 222.699 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.05 | 6 | -5.34 | 2 | 3 | 0 | 44 | 221.691 | 2 | ↓ |
| Lo Low (pH 4.5-6) | -0.05 | 6.55 | -89.88 | 4 | 3 | 2 | 47 | 223.707 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
