In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2011 | 21 | Yes |
Popular Name: 4-[2-(1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)ethoxy]benzonitrile 4-[2-(1-methyl-6,7-dihydro-4H-im…
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) | 0.91 | 7.93 | -36.82 | 1 | 5 | 1 | 55 | 283.355 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.91 | 7.47 | -12.72 | 0 | 5 | 0 | 54 | 282.347 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.