In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 23rd, 2008 | 19 | Yes |
Popular Name: 2-(Benzylamino)-2-(4-fluorophenyl)acetic acid 2-(Benzylamino)-2-(4-fluoropheny…
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CAS Numbers: 159707-18-3 , 200000-54-0 , [200000-54-0]
(Benzylamino)(4-fluorophenyl)acetic acid
(S)-2-(Benzylamino)-2-(4-fluorophenyl)acetic acid
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) | 2.49 | 8.19 | -34.88 | 2 | 3 | 0 | 57 | 259.28 | 5 | ↓ |
Note Type | Comments | Provided By |
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PUBCHEM_PATENT_ID | EP0994867A1; US6048859; US6096742 | IBM Patent Data |