Chemical ID: 6045605

c1ccc(cc1)C(=O)c2ccc(cc2)CC(C(=O)O)N
Chemical ID:
6045605
Name [?]:
2-amino-3-(4-benzoylphenyl)-propanoic acid
SMILES [?]:
c1ccc(cc1)C(=O)c2ccc(cc2)CC(C(=O)O)N
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H15NO3
All Atoms:20
Heavy Atoms:20
Chiral Atoms:1
ZAP Information [?]
Total:8.60098
Area:470.394
Solvation:-3.15886
Coulombic:-50.2385
Bond Count [?]
All:21
Single:13
Double:8
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:269.295
H-Bond Donors:3
H-Bond Acceptors:4
XLogP:0.18
LogP (Chemaxon):0.08

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