o-F-amidine , CAS No.O611127, Inhibitor of peptidyl arginine deiminase 1;Inhibitor of peptidyl arginine deiminase 4

Item Number

O611127

Grouped product items
SKU	Size	Availability	Price	Qty
O611127-5mg	5mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$572.90
O611127-25mg	25mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$2,000.90

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Synonyms

compound 17

Specifications & Purity

Moligand™

Grade

Moligand™

Action Type

INHIBITOR

Mechanism of action

Inhibitor of peptidyl arginine deiminase 1;Inhibitor of peptidyl arginine deiminase 4

Associated Targets(Human)

PADI1 Tchem Protein-arginine deiminase type-1 (1 Activities)

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

PADI4 Tchem Protein-arginine deiminase type-4 (1 Activities)

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

Names and Identifiers

INCHI	InChI=1S/C15H19FN4O4/c16-8-12(17)19-7-3-6-11(13(18)21)20-14(22)9-4-1-2-5-10(9)15(23)24/h1-2,4-5,11H,3,6-8H2,(H2,17,19)(H2,18,21)(H,20,22)(H,23,24)
InChi Key	HBEIARVCIYYMOR-UHFFFAOYSA-N
Canonical SMILES	FCC(=N)NCCCC(C(=O)N)NC(=O)c1ccccc1C(=O)O
Isomeric SMILES	C1=CC=C(C(=C1)C(=O)N[C@@H](CCCN=C(CS)N)C(=O)N)C(=O)O
PubChem CID	53393804

References

1. Causey CP, Jones JE, Slack JL, Kamei D, Jones LE, Subramanian V, Knuckley B, Ebrahimi P, Chumanevich AA, Luo Y et al.. (2011) The development of N-α-(2-carboxyl)benzoyl-N(5)-(2-fluoro-1-iminoethyl)-l-ornithine amide (o-F-amidine) and N-α-(2-carboxyl)benzoyl-N(5)-(2-chloro-1-iminoethyl)-l-ornithine amide (o-Cl-amidine) as second generation protein arginine deiminase (PAD) inhibitors.. J Med Chem, 54 (19): (6919-35). [PMID:21882827] [10.1021/op500134e]

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Basic Description