| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2005 | 14 | Yes |
Popular Name: N-Benzoyl-DL-alanine N-Benzoyl-DL-alanine
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1205-02-3 , 17966-60-8 , 2198-64-3 , [1205-02-3] , [17966-60-8]
2-(benzoylamino)propanoic acid
Benzoyl-L-Alanine [2198-64-3]; (Bz-Ala-OH)
| 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) | -0.75 | 3.57 | -45.79 | 1 | 4 | -1 | 69 | 192.194 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 135-137o C | Indofine |
| Melting_Point | 163-167? | Alfa-Aesar |
| Melting_Point | 163-167° | Alfa-Aesar |
| MP | 166 | TCI |
| ALOGPS_SOLUBILITY | 2.07e+00 g/l | DrugBank-experimental |
| Purity | 97% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
