| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 8th, 2011 | 29 | 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) | 1.17 | 6.37 | -67.95 | 3 | 6 | 1 | 80 | 396.463 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.17 | 4.93 | -19.5 | 2 | 6 | 0 | 79 | 395.455 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
