In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2011 | 15 | Yes |
Popular Name: (5R,6S,7S)-7-isopropyl-2,2,5-trimethyl-3-oxa-1-azabicyclo[4.2.0]octan-8-one (5R,6S,7S)-7-isopropyl-2,2,5-tri…
None
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) | 3.15 | 4.29 | -7.46 | 0 | 3 | 0 | 30 | 211.305 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US4206219 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.