In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 13th, 2006 | 20 | No |
Popular Name: N-[1-(S)-Ethoxycarbonyl-3-phenylpropyl]-L-alanine N-[1-(S)-Ethoxycarbonyl-3-phenyl…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 122076-80-6 , 80828-26-8 , 82717-96-2
(-)-N-[1-(R)-Ethoxycarbonxyl-3-phenylpropyl)-D-alanine
(s)-2-((s)-1-ethoxy-1-oxo-4-phenylbutan-2-ylamino)propanoicacid
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) | 0.77 | 1.44 | -41.85 | 2 | 5 | 0 | 83 | 279.336 | 9 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Melting_Point | 150-152? | Alfa-Aesar |
Melting_Point | 150-152° | Alfa-Aesar |
PUBCHEM_PATENT_ID | EP0338508A2 | IBM Patent Data |