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Compound: 5546
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References: 992
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thiazole
ScientificNameLabel
thiazole
PHCD compound ID :
2444
Chemical Names :
thiazole
Molecular Formula :
C3H3N1S1
Molecular Weight :
84.99862
More Details :
Names & Synonyms:
thiazole , 1,3-thiazole
Smiles:
c1nccs1
InChi :
InChI=1S/C3H3NS/c1-2-5-3-4-1/h1-3H
InChi Key :
InChIKey=FZWLAAWBMGSTSO-UHFFFAOYSA-N
PubChem ID :
9256
Rotatable bond count :
0
Rule of five :
0
Hydrogen bond acceptor count :
1
Ionization potential :
9.631203
Hydrogen bond donor count :
0
Electric dipole moment :
1.859
XLogP :
0.602
VDW volume :
61.420821
Molecular weight :
84.99862
HOMO-LUMO gap :
8.722000
Herb list :
Ginseng - Panax ginseng - جین سینگ، ژین سینگ
Refrences & Litretures:
277. Journal:'Drug Discoveries & Therapeutics' Year:'2015' Volume:'9' Page:'23' DOI:'10.5582/ddt.2015.01004' Title:'Chemical constituents and bioactivities of Panax ginseng (C. A. Mey.)'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
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