A1P   Click here for help

GtoPdb Ligand ID: 8806

Synonyms: compound 10 [PMID: 20441173]
Compound class: Synthetic organic
Comment: A1P is reported as an inhibitor of human arginase 1 [1].
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 5
Hydrogen bond donors 3
Rotatable bonds 5
Topological polar surface area 107.16
Molecular weight 198.11
XLogP -2.8
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES OC(=O)C(CCCn1ccnc1N)N
Isomeric SMILES OC(=O)[C@H](CCCn1ccnc1N)N
InChI InChI=1S/C8H14N4O2/c9-6(7(13)14)2-1-4-12-5-3-11-8(12)10/h3,5-6H,1-2,4,9H2,(H2,10,11)(H,13,14)/t6-/m0/s1
InChI Key WGFGZNVQMGCHHV-LURJTMIESA-N
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
(2S)-2-amino-5-(2-aminoimidazol-1-yl)pentanoic acid
Synonyms Click here for help
compound 10 [PMID: 20441173]
Database Links Click here for help
ChEMBL Ligand CHEMBL1099169
GtoPdb PubChem SID 252827464
PubChem CID 10241837
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