In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 7th, 2011 | 24 | 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) | 2.77 | 4 | -47.37 | 1 | 7 | -1 | 92 | 345.766 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.32 | 5.42 | -17.33 | 2 | 7 | 0 | 89 | 346.774 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.