DDO-3055   Click here for help

GtoPdb Ligand ID: 12785

Synonyms: compound 17 [PMID: 32787144] | DDO3055
Compound class: Synthetic organic
Comment: DDO-3055 is an inhibitor of the prolyl hydroxylase PHD2 (egl-9 family hypoxia inducible factor 1; EGLN1) [1]. It increases the plasma erythropoietin level and alleviates anemia in vivo.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 7
Hydrogen bond donors 3
Rotatable bonds 6
Topological polar surface area 108.22
Molecular weight 360.75
XLogP 1.34
No. Lipinski's rules broken 0
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Canonical SMILES C(#CC1=CN=C(C(=C1)O)C(=O)NCC(=O)O)COC2=CC=C(C=C2)Cl
InChI InChI=1S/C17H13ClN2O5/c18-12-3-5-13(6-4-12)25-7-1-2-11-8-14(21)16(19-9-11)17(24)20-10-15(22)23/h3-6,8-9,21H,7,10H2,(H,20,24)(H,22,23)
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
2-[[5-[3-(4-chlorophenoxy)prop-1-ynyl]-3-hydroxypyridine-2-carbonyl]amino]acetic acid
Synonyms Click here for help
compound 17 [PMID: 32787144] | DDO3055
Database Links Click here for help
BindingDB Ligand 50318679
CAS Registry No. 1842340-93-5 (source: PubChem)
ChEMBL Ligand CHEMBL4162752
GtoPdb PubChem SID 483123333
PubChem CID 129027150
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