UK 396082
(2S)-5-amino-2-[(1-propylimidazol-4-yl)methyl]pentanoic acid
Molecular Identity
UK 396082
(2S)-5-amino-2-[(1-propylimidazol-4-yl)methyl]pentanoic acid
PubChem CID: 11241908
2D Structure
Properties
C12H21N3O2
Molecular Formula
239.31
Molecular Weight
g/mol
239.1634
Exact Mass
Da
-1.8
XLogP
Drug-like (Lipinski: < 5)
81.1
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
4
H-Bond Acceptors
236
Complexity
SMILES
Canonical SMILES
SMILES: CCCN1C=C(N=C1)CC(CCCN)C(=O)OIsomeric SMILES
SMILES: CCCN1C=C(N=C1)C[C@H](CCCN)C(=O)OSynonyms(20)
400044-47-5UK-396082UK-396,082UK 3960822Q5861SUIG(2s)-5-Amino-2-[(1-Propyl-1h-Imidazol-4-Yl)methyl]pentanoic Acid(2S)-5-amino-2-[(1-propylimidazol-4-yl)methyl]pentanoic acidDTXSID701930741H-Imidazole-4-propanoic acid, alpha-(3-aminopropyl)-1-propyl-, (alphaS)-(2S)-5-amino-2-((1-propylimidazol-4-yl)methyl)pentanoic acid(2S)-5-amino-2-((1-propyl-1H-imidazol-4-yl)methyl)pentanoic acidUK396082RefChem:192972DTXCID80115565UK396,082
Data from PubChem (NCBI)
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