In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2010 | 24 | Yes |
Popular Name: 1-butanoyl-N-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethyl]piperidine-4-carboxamide 1-butanoyl-N-[2-[(2S,6R)-2,6-dim…
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 | 4.21 | -14.15 | 1 | 6 | 0 | 62 | 339.48 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.58 | 6.48 | -50.33 | 2 | 6 | 1 | 63 | 340.488 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.