In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2010 | 16 | Yes |
Popular Name: [(1R,2S)-2-aminocyclohexyl]-(4-methyl-1-piperidyl)methanone [(1R,2S)-2-aminocyclohexyl]-(4-m…
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) | 1.46 | 4.64 | -39.42 | 3 | 3 | 1 | 48 | 225.356 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US5273983 | IBM Patent Data |