In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 5th, 2011 | 27 | 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) | 5.13 | 8.52 | -48.5 | 2 | 5 | -1 | 85 | 422.313 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.