In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2011 | 17 | Yes |
Popular Name: (3S,5S)-5-methyl-3-(1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)tetrahydrofuran-2-one (3S,5S)-5-methyl-3-(1-methyl-6,7…
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) | -1.58 | 5.92 | -38.9 | 1 | 5 | 1 | 49 | 236.295 | 1 | ↓ |
Hi High (pH 8-9.5) | -1.58 | 5.46 | -11.59 | 0 | 5 | 0 | 47 | 235.287 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.