| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 26th, 2010 | 32 | 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) | 3.21 | 5.76 | -9.23 | 3 | 8 | 0 | 98 | 442.56 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.21 | 6.9 | -43.55 | 4 | 8 | 1 | 102 | 443.568 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
