Chemical ID: 4377851

c1cc(cc(c1)NC(=O)CS)C(=O)O
Chemical ID:
4377851
Name [?]:
3-(2-sulfanylacetyl)aminobenzoic acid
SMILES [?]:
c1cc(cc(c1)NC(=O)CS)C(=O)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C9H9NO3S
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:6.01607
Area:381.749
Solvation:-3.52766
Coulombic:-48.783
Bond Count [?]
All:14
Single:9
Double:5
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:211.239
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:1.04
LogP (Chemaxon):0.92

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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