Chemical ID: 4728456

C(CS(=O)(=O)O)NC(=N)N
Chemical ID:
4728456
Name [?]:
2-guanidinoethanesulfonic acid
SMILES [?]:
C(CS(=O)(=O)O)NC(=N)N
InChi [?]:
InChI=1/C3H9N3O3S/c4-3(5)6-1-2-10(7,8)9/h1-2H2,(H4,4,5,6)(H,7,8,9)
InChi Info:
AuxInfo=1/1/N:1,2,8,9,10,7,4,5,6,3/E:(4,5)(7,8,9)/CRV:10.6/rA:10nCCSOOONCNN/rB:s1;s2;d3;d3;s3;s1;s7;w8;s8;/rC:;;;;;;;;;;

Chemical Details

Atom Count
Formula:C3H9N3O3S
All Atoms:10
Heavy Atoms:10
Chiral Atoms:0
ZAP Information [?]
Total:5.07316
Area:322.712
Solvation:-2.99464
Coulombic:-52.1342
Bond Count [?]
All:9
Single:6
Double:3
Rotors:4
Chiral:1
Rigid Segments:3
Chemical Properties
Molecular Weight:167.188
H-Bond Donors:5
H-Bond Acceptors:6
XLogP:-1.36
LogP (Chemaxon):-2.33

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