Chemical ID: 4736110

c1cnc(nc1)S
Chemical ID:
4736110
Name [?]:
pyrimidine-2-thiol
SMILES [?]:
c1cnc(nc1)S
InChi [?]:
InChI=1/C4H4N2S/c7-4-5-2-1-3-6-4/h1-3H,(H,5,6,7)
InChi Info:
AuxInfo=1/1/N:1,2,6,4,3,5,7/E:(2,3)(5,6)/rA:7nCCNCNCS/rB:s1;d2;s3;d4;d1s5;s4;/rC:;;;;;;;

Chemical Details

Atom Count
Formula:C4H4N2S
All Atoms:7
Heavy Atoms:7
Chiral Atoms:0
ZAP Information [?]
Total:4.75177
Area:250.347
Solvation:-1.5069
Coulombic:-12.094
Bond Count [?]
All:7
Single:4
Double:3
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:112.154
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:0.2
LogP (Chemaxon):0.68

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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