Danegaptide
(2S,4R)-1-(2-aminoacetyl)-4-benzamidopyrrolidine-2-carboxylic acid
Molecular Identity
Danegaptide
(2S,4R)-1-(2-aminoacetyl)-4-benzamidopyrrolidine-2-carboxylic acid
PubChem CID: 16656685
Danegaptide is a dipeptide.
2D Structure
Properties
C14H17N3O4
Molecular Formula
291.30
Molecular Weight
g/mol
291.1219
Exact Mass
Da
-2.7
XLogP
Drug-like (Lipinski: < 5)
113
TPSA
Good oral absorption (< 140 A²)
3
H-Bond Donors
5
H-Bond Acceptors
420
Complexity
SMILES
Canonical SMILES
SMILES: C1C(CN(C1C(=O)O)C(=O)CN)NC(=O)C2=CC=CC=C2Isomeric SMILES
SMILES: C1[C@H](CN([C@@H]1C(=O)O)C(=O)CN)NC(=O)C2=CC=CC=C2Synonyms(20)
DANEGAPTIDE943134-39-2GAP-134(2S,4R)-1-(2-aminoacetyl)-4-benzamidopyrrolidine-2-carboxylic acidDanegaptidaZP1609PA0Y7735ATZP-1609glycyl-(4R)-4-(benzoylamino)-L-prolineL-Proline, glycyl-4-(benzoylamino)-, (4R)-DTXSID201026039(2S,4R)-1-(AMINOACETYL)-4-(BENZOYLAMINO)PYRROLIDINE-2-CARBOXYLIC ACIDdanegaptidum[2s,4r]-1-(2-aminoacetyl)-4-benzamidopyrrolidine-2-carboxylic acidRefChem:919625
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Danegaptide
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