In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 4th, 2009 | 18 | Yes |
Popular Name: (3R,6R,7aS)-6-allyl-3-phenyl-3,6,7,7a-tetrahydro-1H-pyrrolo[1,2-c]oxazol-5-one (3R,6R,7aS)-6-allyl-3-phenyl-3,6…
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) | 3.38 | 6.44 | -11.09 | 0 | 3 | 0 | 30 | 243.306 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | WO1992002521A1 | IBM Patent Data |