Basic information
- Standard SMILES
N#Cc1ncc(N)cc1C(=O)[C@H](CCC(=O)O)NC(=O)c1cccc2c1CCCC2- InChIKey
RAUMXQLMPDVSCC-SFHVURJKSA-N- Molecular formula
- C22H22N4O4
- Average molar mass
- 406.4 g/mol
Names & identifiers
- Preferred name
- N-5,6,7,8-tetrahydro-1-naphthoyl-alpha-L-glutamyl-5-aminopyridine-2-carbonitrile
- IUPAC
- (4S)-5-(5-amino-2-cyano-3-pyridinyl)-5-oxo-4-(5,6,7,8-tetrahydronaphthalene-1-carbonylamino)pentanoic acid
Names & synonyms
RAUMXQLMPDVSCC-SFHVURJKSA-NN-5,6,7,8-tetrahydro-1-naphthoyl-alpha-L-glutamyl-5-aminopyridine-2-carbonitrile
Database identifiers
- PubChem CID
- 86747423
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 146 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 702
Related reactions
1 records
Compound notes
Loading…