In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2010 | 26 | Yes |
Popular Name: 1'-cyclohexyl-1-isobutyl-spiro[4H-quinoxaline-3,4'-piperidine]-2-one 1'-cyclohexyl-1-isobutyl-spiro[4…
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) | 4.55 | 11.37 | -39.19 | 2 | 4 | 1 | 37 | 356.534 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.55 | 9.02 | -5.23 | 1 | 4 | 0 | 36 | 355.526 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.