carglumic acid   Click here for help

GtoPdb Ligand ID: 7458

Synonyms: N-carbamylglutamate | Carbaglu® | OE-312
Approved drug
carglumic acid is an approved drug (EMA (2003), FDA (2010))
Compound class: Synthetic organic
Comment: Carglumic acid is an orphan drug.
2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 7
Hydrogen bond donors 4
Rotatable bonds 6
Topological polar surface area 129.72
Molecular weight 190.06
XLogP -1.78
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES OC(=O)CCC(C(=O)O)NC(=O)N
Isomeric SMILES OC(=O)CC[C@@H](C(=O)O)NC(=O)N
InChI InChI=1S/C6H10N2O5/c7-6(13)8-3(5(11)12)1-2-4(9)10/h3H,1-2H2,(H,9,10)(H,11,12)(H3,7,8,13)/t3-/m0/s1
InChI Key LCQLHJZYVOQKHU-VKHMYHEASA-N
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (EMA (2003), FDA (2010))
IUPAC Name Click here for help
(2S)-2-(carbamoylamino)pentanedioic acid
International Nonproprietary Names Click here for help
INN number INN
8008 carglumic acid
Synonyms Click here for help
N-carbamylglutamate | Carbaglu® | OE-312
Database Links Click here for help
CAS Registry No. 1188-38-1
ChEBI CHEBI:71028
ChEMBL Ligand CHEMBL1201780
DrugBank Ligand DB06775
DrugCentral Ligand 3068
GtoPdb PubChem SID 187051761
PubChem CID 121396
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Wikipedia Carglumic acid