(2S)-2-amino-4-methylsulfanylbutanoic acid;molybdenum

C5H11MoNO2S — CID 174796438

IUPAC(2S)-2-amino-4-methylsulfanylbutanoic acid;molybdenum
SMILESCSCC[C@H](N)C(=O)O.[Mo]
InChIInChI=1S/C5H11NO2S.Mo/c1-9-3-2-4(6)5(7)8;/h4H,2-3,6H2,1H3,(H,7,8);/t4-;/m0./s1
InChIKeyNOLUEBRJDXLAII-WCCKRBBISA-N
MW245.15 g/mol
LogP0.15
Rot. Bonds4

About (2S)-2-amino-4-methylsulfanylbutanoic acid;molybdenum

(2S)-2-amino-4-methylsulfanylbutanoic acid;molybdenum (PubChem CID 174796438) has the molecular formula C5H11MoNO2S and a molecular weight of 245.15 g/mol. Its IUPAC name is (2S)-2-amino-4-methylsulfanylbutanoic acid;molybdenum.

Molecular Properties

Compound Name(2S)-2-amino-4-methylsulfanylbutanoic acid;molybdenum
PubChem CID174796438
Molecular FormulaC5H11MoNO2S
Molecular Weight245.15 g/mol
Exact Mass246.96
IUPAC Name(2S)-2-amino-4-methylsulfanylbutanoic acid;molybdenum
SMILESCSCC[C@H](N)C(=O)O.[Mo]
InChIInChI=1S/C5H11NO2S.Mo/c1-9-3-2-4(6)5(7)8;/h4H,2-3,6H2,1H3,(H,7,8);/t4-;/m0./s1
InChIKeyNOLUEBRJDXLAII-WCCKRBBISA-N
XLogP0.15
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.15
LogP ≤ 50.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (2S)-2-amino-4-methylsulfanylbutanoic acid;molybdenum with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-2-(15N)azanyl-4-(113C)methylsulfanylbutanoic acid
CID 131708710
(2R)-2-(15N)azanyl-4-methylsulfanylbutanoic acid
CID 150150636
(2S)-2-amino-4-methylsulfanylbutanoic acid
CID 6137
2-amino-4-(113C)methylsulfanylbutanoic acid
CID 15556496
2-amino-4-methylsulfanylbutanoic acid
CID 876
(2S)-2-amino-4-methylsulfanylbutanoic acid;copper
CID 87289409
CID 173007920
CID 173007920
bis((2S)-2-amino-4-methylsulfanylbutanoic acid);zinc
CID 132989209
(2S)-2-amino-4-methylsulfanylbutanoic acid;formaldehyde
CID 161434008
2-amino-4-methylsulfanylbutanoic acid;sulfane;hydrate
CID 174389151
(2S)-2-amino-4-methylsulfanylbutanoic acid;ethene
CID 88715356
CID 173070734
CID 173070734

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-4-methylsulfanylbutanoic acid;molybdenum?
The IUPAC name of (2S)-2-amino-4-methylsulfanylbutanoic acid;molybdenum (CID 174796438) is (2S)-2-amino-4-methylsulfanylbutanoic acid;molybdenum.
What is the SMILES notation for (2S)-2-amino-4-methylsulfanylbutanoic acid;molybdenum?
The canonical SMILES for (2S)-2-amino-4-methylsulfanylbutanoic acid;molybdenum is CSCC[C@H](N)C(=O)O.[Mo].
What is the InChIKey of (2S)-2-amino-4-methylsulfanylbutanoic acid;molybdenum?
The InChIKey is NOLUEBRJDXLAII-WCCKRBBISA-N. The full InChI is InChI=1S/C5H11NO2S.Mo/c1-9-3-2-4(6)5(7)8;/h4H,2-3,6H2,1H3,(H,7,8);/t4-;/m0./s1.
What are the key properties of (2S)-2-amino-4-methylsulfanylbutanoic acid;molybdenum?
(2S)-2-amino-4-methylsulfanylbutanoic acid;molybdenum has a molecular weight of 245.15 g/mol, XLogP of 0.15, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-4-methylsulfanylbutanoic acid;molybdenum is sourced from PubChem (CID 174796438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).