In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 21st, 2011 | 13 | 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) | 0.24 | 4.35 | -38.45 | 1 | 5 | 1 | 58 | 179.203 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.24 | 3.83 | -11.5 | 0 | 5 | 0 | 57 | 178.195 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.