In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 5th, 2011 | 22 | Yes |
Popular Name: [(3aR)-3a,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[4-(trifluoromethoxy)phenyl]methanone [(3aR)-3a,4,6,7-tetrahydroimidaz…
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) | 1.78 | 6.32 | -42.28 | 2 | 5 | 1 | 59 | 312.271 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.78 | 5.84 | -9.99 | 1 | 5 | 0 | 58 | 311.263 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.