In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 24th, 2009 | 14 | 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) | 0.55 | 1.71 | -34.39 | 3 | 3 | 1 | 37 | 197.302 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.55 | 2.82 | -95.03 | 4 | 3 | 2 | 41 | 198.31 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.