Chemical ID: 4259493

Cc1c(sc[n+]1Cc2cnc(nc2[NH3+])C)CCO
Chemical ID:
4259493
Name [?]:
[5-[[5-(2-hydroxyethyl)-4-methyl-thiazol-3-yl]methyl]-2-methyl-pyrimidin-4-yl]ammonium
SMILES [?]:
Cc1c(sc[n+]1Cc2cnc(nc2[NH3+])C)CCO
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C12H18N4OS+2
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:-99.6637
Area:454.985
Solvation:-111.038
Coulombic:93.147
Bond Count [?]
All:19
Single:14
Double:5
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:266.364
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:0.77
LogP (Chemaxon):-3.27

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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