In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2004 | 17 | Yes |
Popular Name: 4-Cyano-pyrrolidine-1,2-dicarboxylic acid 1-tert-butyl ester 4-Cyano-pyrrolidine-1,2-dicarbox…
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CAS Number: 273221-94-6
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) | 0.34 | 5.98 | -56.46 | 0 | 6 | -1 | 93 | 239.251 | 3 | ↓ |
Note Type | Comments | Provided By |
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PUBCHEM_PATENT_ID | US5120859 | IBM Patent Data |