In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2010 | 14 | Yes |
None
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) | -0.56 | 4.58 | -46.73 | 1 | 4 | 1 | 47 | 192.242 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.56 | 2.1 | -8.87 | 0 | 4 | 0 | 46 | 191.234 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.