In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 19th, 2008 | 33 | No |
Popular Name: (2S)-1,3-Diphenylpropyl 1-(3,3-dimethyl-2-oxopentanoyl)piperidine-2-carboxylate (2S)-1,3-Diphenylpropyl 1-(3,3-d…
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CAS Number: 200417-73-8
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) | 5.53 | 16.48 | -9.04 | 0 | 5 | 0 | 64 | 449.591 | 10 | ↓ |
Note Type | Comments | Provided By |
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PUBCHEM_PATENT_ID | EP0777478A1; US5798355; WO1999062483A1; WO2000009109A2 | IBM Patent Data |
PUBCHEM_PATENT_ID | US5843960 | IBM Patent Data |