1 2D Structure

2D Structure

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

sodium;(4Z)-3-hydroxy-4-(pyridin-2-ylhydrazinylidene)cyclohexa-2,5-dien-1-one

2.1.2 InChI

InChI=1S/C11H9N3O2.Na/c15-8-4-5-9(10(16)7-8)13-14-11-3-1-2-6-12-11;/h1-7,16H,(H,12,14);/q;+1/b13-9-;

2.1.3 InChI Key

QWZUIMCIEOCSJF-CHHCPSLASA-N

2.1.4 Canonical SMILES

C1=CC=NC(=C1)NN=C2C=CC(=O)C=C2O.[Na+]

2.1.5 Isomeric SMILES

C1=CC=NC(=C1)N/N=C\2/C=CC(=O)C=C2O.[Na+]

2.2 Create Date

2011-12-19

3 Chemical and Physical Properties

Molecular Formula	C₁₁H₉N₃NaO₂+
Molecular Weight	238.20 g/mol
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	2
Exact Mass	238.05924582 g/mol
Monoisotopic Mass	238.05924582 g/mol
Topological Polar Surface Area	74.6 A^2
Heavy Atom Count	17
Formal Charge	1
Complexity	371
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	2

4 Drug and Medication Information

4.1 Drug Information

1 of 6
Drug Name	ULTRESA
Active Ingredient	PANCRELIPASE (AMYLASE;LIPASE;PROTEASE)
Company	FOREST LABS INC (Application Number: N022222)

2 of 6
Drug Name	VIOKACE
Active Ingredient	PANCRELIPASE (AMYLASE;LIPASE;PROTEASE)
Company	FOREST LABS INC (Application Number: N022542)

3 of 6
Drug Name	ZENPEP
Active Ingredient	PANCRELIPASE (AMYLASE;LIPASE;PROTEASE)
Company	FOREST LABS INC (Application Number: N022210. Patents: 7658918, 8221747, 8246950, 8562978, 8562979, 8562980, 8562981)

4 of 6
Drug Name	CREON
Active Ingredient	PANCRELIPASE (AMYLASE;LIPASE;PROTEASE)
Company	ABBVIE (Application Number: N020725. Patent: 9198871)

5 of 6
Drug Name	PANCREAZE
Active Ingredient	PANCRELIPASE (AMYLASE;LIPASE;PROTEASE)
Company	JANSSEN PHARMS (Application Number: N022523. Patents: 8221747, 8562978, 8562979, 8562980, 8562981)

6 of 6
Drug Name	PERTZYE
Active Ingredient	PANCRELIPASE (AMYLASE;LIPASE;PROTEASE)
Company	DIGESTIVE CARE INC (Application Number: N022175)

Lipase