| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 6th, 2012 | 28 | 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) | 2.49 | 9.56 | -44.14 | 4 | 6 | 0 | 114 | 383.444 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.49 | 9.3 | -50.99 | 3 | 6 | -1 | 113 | 382.436 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.