Asparagylthreonylarginine
5-(diaminomethylideneamino)-2-[[2-[(2,4-diamino-4-oxobutanoyl)amino]-3-hydroxybutanoyl]amino]pentanoic acid
Molecular Identity
Asparagylthreonylarginine
5-(diaminomethylideneamino)-2-[[2-[(2,4-diamino-4-oxobutanoyl)amino]-3-hydroxybutanoyl]amino]pentanoic acid
PubChem CID: 19829695
2D Structure
Properties
C14H27N7O6
Molecular Formula
389.41
Molecular Weight
g/mol
389.2023
Exact Mass
Da
-6.8
XLogP
Drug-like (Lipinski: < 5)
249
TPSA
May have limited oral absorption
8
H-Bond Donors
8
H-Bond Acceptors
578
Complexity
SMILES
Canonical SMILES
SMILES: CC(C(C(=O)NC(CCCN=C(N)N)C(=O)O)NC(=O)C(CC(=O)N)N)OIsomeric SMILES
SMILES: CC(C(C(=O)NC(CCCN=C(N)N)C(=O)O)NC(=O)C(CC(=O)N)N)OSynonyms(3)
asparagylthreonylarginineJXMREEPBRANWBY-UHFFFAOYSA-NNTR
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Asparagylthreonylarginine
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