Chemical ID: 5003136

c1ccc(cc1)CC(=O)NCCC(=O)[O-]
Chemical ID:
5003136
Name [?]:
3-(2-phenylacetyl)aminopropanoate
SMILES [?]:
c1ccc(cc1)CC(=O)NCCC(=O)[O-]
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C11H12NO3-
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:-34.7146
Area:403.239
Solvation:-44.7956
Coulombic:-19.4171
Bond Count [?]
All:15
Single:10
Double:5
Rotors:6
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:206.218
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:0.3
LogP (Chemaxon):0.78

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue