In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2010 | 17 | 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) | 0.65 | 2.26 | -10.82 | 2 | 5 | 0 | 75 | 230.223 | 1 | ↓ |
Mid Mid (pH 6-8) | 0.65 | 3.02 | -39.09 | 3 | 5 | 1 | 76 | 231.231 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.