| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2004 | 22 | Yes |
Popular Name: Boc-(S)-3-amino-4-(2-cyano-phenyl)-butyric acid Boc-(S)-3-amino-4-(2-cyano-pheny…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 269726-80-9 , 270065-83-3 , [270065-83-3]
Boc-(S)-3-amino-4-(2-cyanophenyl)-butyric acid
Boc-(S)-3-Amino-4-(2-cyanophenyl)butanoic acid
Boc-2-cyano-D-beta-homophenylalanine
| 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) | 3.95 | 2.35 | -54.77 | 1 | 6 | -1 | 102 | 303.338 | 7 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.
