In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2008 | 30 | 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) | 5.12 | 12.88 | -17.56 | 0 | 6 | 0 | 58 | 445.972 | 11 | ↓ |
No pre-computed analogs available. Try a structural similarity search.