Chemical ID: 4557091

CCCOc1ccc(cc1)C(=O)CCNC(C(C)CC)C(=O)O
Chemical ID:
4557091
Name [?]:
3-methyl-2-[3-oxo-3-(4-propoxyphenyl)-propyl]amino-pentanoic acid
SMILES [?]:
CCCOc1ccc(cc1)C(=O)CCNC(C(C)CC)C(=O)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H27NO4
All Atoms:23
Heavy Atoms:23
Chiral Atoms:2
ZAP Information [?]
Total:10.4284
Area:573.954
Solvation:-3.92042
Coulombic:-52.802
Bond Count [?]
All:23
Single:18
Double:5
Rotors:11
Chiral:0
Rigid Segments:9
Chemical Properties
Molecular Weight:321.411
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:3.13
LogP (Chemaxon):0.49

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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