In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 5th, 2011 | 17 | Yes |
Popular Name: [(3aR)-3a,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-(5-bromo-2-furyl)methanone [(3aR)-3a,4,6,7-tetrahydroimidaz…
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) | 1.47 | 5.56 | -38.56 | 2 | 5 | 1 | 63 | 297.132 | 1 | ↓ |
Hi High (pH 8-9.5) | 1.47 | 5.09 | -9.67 | 1 | 5 | 0 | 62 | 296.124 | 1 | ↓ |
Hi High (pH 8-9.5) | 1.47 | 5.1 | -9.63 | 1 | 5 | 0 | 62 | 296.124 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.