Chemical ID: 4698325

CCSc1ncc(n1C)c2cc(c3ccccc3n2)C(=O)O
Chemical ID:
4698325
Name [?]:
2-(2-ethylsulfanyl-3-methyl-imidazol-4-yl)quinoline-4-carboxylic acid
SMILES [?]:
CCSc1ncc(n1C)c2cc(c3ccccc3n2)C(=O)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H15N3O2S
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:9.97542
Area:502.488
Solvation:-2.5868
Coulombic:-46.1443
Bond Count [?]
All:24
Single:16
Double:8
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:313.375
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.14
LogP (Chemaxon):2.5

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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