Basic information
- Standard SMILES
NC(=O)CC(CS)C(=O)N1CCCC1C(=O)O- InChIKey
YUUYYVRVANFWIR-UHFFFAOYSA-N- Molecular formula
- C10H16N2O4S
- Average molar mass
- 260.31 g/mol
- Monoisotopic mass
- 260.08307817
Names & identifiers
- Preferred name
- 1-[4-Amino-4-oxo-2-(sulfanylmethyl)butanoyl]pyrrolidine-2-carboxylic acid
- IUPAC
- 1-[4-amino-4-oxo-2-(sulfanylmethyl)butanoyl]pyrrolidine-2-carboxylic acid
Database identifiers
- PubChem CID
- 14181599
Properties
Computed structural properties
- XLogP
- -1.3
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 334
Related reactions
2 records
Compound notes
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