In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2011 | 28 | Yes |
Popular Name: 1-[[1-[6-(1,4-oxazepan-4-yl)pyridine-3-carbonyl]-4-piperidyl]methyl]pyrrolidin-2-one 1-[[1-[6-(1,4-oxazepan-4-yl)pyri…
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) | 0.76 | 8.86 | -15.15 | 0 | 7 | 0 | 66 | 386.496 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.76 | 9.16 | -41.06 | 1 | 7 | 1 | 67 | 387.504 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.