In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2004 | 15 | Yes |
Popular Name: (3R,7aS)-3-Phenyltetrahydropyrrolo[1,2-c]oxazol-5(3H)-one (3R,7aS)-3-Phenyltetrahydropyrro…
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CAS Numbers: 103201-79-2 , [103201-79-2]
(+)-(3R,7aS)-Tetrahydro-3-phenyl-3H,5H-pyrrolo[1,2-c]oxaole-5-one
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) | 1.47 | 4.63 | -11.01 | 0 | 3 | 0 | 30 | 203.241 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Purity | 95% | Fluorochem |
PUBCHEM_PATENT_ID | US5373002 | IBM Patent Data |