zinc;(2R)-2-amino-3-sulfanylpropanoic acid;oxygen(2-)

C3H7NO3SZn — CID 157249919

IUPACzinc;(2R)-2-amino-3-sulfanylpropanoic acid;oxygen(2-)
SMILESN[C@@H](CS)C(=O)O.[O-2].[Zn+2]
InChIInChI=1S/C3H7NO2S.O.Zn/c4-2(1-7)3(5)6;;/h2,7H,1,4H2,(H,5,6);;/q;-2;+2/t2-;;/m0../s1
InChIKeyFTJFXJNWTMQYAT-JIZZDEOASA-N
MW202.55 g/mol
LogP-0.79
Rot. Bonds2

About zinc;(2R)-2-amino-3-sulfanylpropanoic acid;oxygen(2-)

zinc;(2R)-2-amino-3-sulfanylpropanoic acid;oxygen(2-) (PubChem CID 157249919) has the molecular formula C3H7NO3SZn and a molecular weight of 202.55 g/mol. Its IUPAC name is zinc;(2R)-2-amino-3-sulfanylpropanoic acid;oxygen(2-).

Molecular Properties

Compound Namezinc;(2R)-2-amino-3-sulfanylpropanoic acid;oxygen(2-)
PubChem CID157249919
Molecular FormulaC3H7NO3SZn
Molecular Weight202.55 g/mol
Exact Mass200.94
IUPAC Namezinc;(2R)-2-amino-3-sulfanylpropanoic acid;oxygen(2-)
SMILESN[C@@H](CS)C(=O)O.[O-2].[Zn+2]
InChIInChI=1S/C3H7NO2S.O.Zn/c4-2(1-7)3(5)6;;/h2,7H,1,4H2,(H,5,6);;/q;-2;+2/t2-;;/m0../s1
InChIKeyFTJFXJNWTMQYAT-JIZZDEOASA-N
XLogP-0.79
TPSA91.82 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.55
LogP ≤ 5-0.79
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Related Compounds

(2R)-2-amino-3-sulfanylpropanoic acid;2-amino-3-sulfanylpropanoic acid
CID 87266348
(2S)-2-amino-3-sulfanylpropanoic acid;2-amino-3-sulfanylpropanoic acid
CID 138731668
2-amino-3-sulfanylpropanoic acid
CID 21459566
CID 87623250
CID 87623250
(2R)-2-amino-3-sulfanylpropanoic acid;iron
CID 87142909
2-amino-3-sulfanylpropanoic acid;hydrofluoride
CID 174867150
2-amino-3-sulfanylpropanoic acid;molecular oxygen
CID 141222911
2-amino-3-sulfanylpropanoic acid chloride
CID 22609099
sodium;2-amino-3-sulfanylpropanoic acid;hydride
CID 173209935
(2S)-2-amino-3-sulfanylpropanoic acid;methane;hydrochloride
CID 87203931
(2S)-2-amino-3-hydroxypropanoic acid;(2R)-2-amino-3-sulfanylpropanoic acid
CID 87207256
calcium;(2R)-2-amino-3-sulfanylpropanoic acid;carbonate
CID 161349060

Frequently Asked Questions

What is the IUPAC name of zinc;(2R)-2-amino-3-sulfanylpropanoic acid;oxygen(2-)?
The IUPAC name of zinc;(2R)-2-amino-3-sulfanylpropanoic acid;oxygen(2-) (CID 157249919) is zinc;(2R)-2-amino-3-sulfanylpropanoic acid;oxygen(2-).
What is the SMILES notation for zinc;(2R)-2-amino-3-sulfanylpropanoic acid;oxygen(2-)?
The canonical SMILES for zinc;(2R)-2-amino-3-sulfanylpropanoic acid;oxygen(2-) is N[C@@H](CS)C(=O)O.[O-2].[Zn+2].
What is the InChIKey of zinc;(2R)-2-amino-3-sulfanylpropanoic acid;oxygen(2-)?
The InChIKey is FTJFXJNWTMQYAT-JIZZDEOASA-N. The full InChI is InChI=1S/C3H7NO2S.O.Zn/c4-2(1-7)3(5)6;;/h2,7H,1,4H2,(H,5,6);;/q;-2;+2/t2-;;/m0../s1.
What are the key properties of zinc;(2R)-2-amino-3-sulfanylpropanoic acid;oxygen(2-)?
zinc;(2R)-2-amino-3-sulfanylpropanoic acid;oxygen(2-) has a molecular weight of 202.55 g/mol, XLogP of -0.79, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for zinc;(2R)-2-amino-3-sulfanylpropanoic acid;oxygen(2-) is sourced from PubChem (CID 157249919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).