In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2011 | 21 | Yes |
Popular Name: 1-[2-(azocan-1-yl)-2-oxo-ethyl]-N-methyl-piperidine-4-carboxamide 1-[2-(azocan-1-yl)-2-oxo-ethyl]-…
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) | 1.49 | 6.84 | -49.82 | 2 | 5 | 1 | 54 | 296.435 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.49 | 4.68 | -16.23 | 1 | 5 | 0 | 53 | 295.427 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.