LZ5

N-phenyl-1H-pyrazole-3-carboxamide

Created:	2008-05-15
Last modified:	2011-06-04

Find Related PDB Entry
1 entries where LZ5 is found as a standalone ligand

Help Find related ligands:
Similar Ligands (Stereospecific) Similar Ligands (including Stereoisomers) Similar Ligands (Quick Screen) Similar Ligands (Substructure Stereospecific) Similar Ligands (Substructure including Stereoisomers)

Help

Find related ligands:

Similar Ligands (Stereospecific) Similar Ligands (including Stereoisomers) Similar Ligands (Quick Screen) Similar Ligands (Substructure Stereospecific) Similar Ligands (Substructure including Stereoisomers)

Chemical Details
Formal Charge	0
Atom Count	23
Chiral Atom Count	0
Bond Count	24
Aromatic Bond Count	11

Toggle Hydrogen Toggle Labels

Chemical Component Summary
Name	N-phenyl-1H-pyrazole-3-carboxamide
Systematic Name (OpenEye OEToolkits)	N-phenyl-1H-pyrazole-3-carboxamide
Formula	C₁₀ H₉ N₃ O
Molecular Weight	187.198
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=C(Nc1ccccc1)c2nncc2
SMILES	CACTVS	3.341	O=C(Nc1ccccc1)c2cc[nH]n2
SMILES	OpenEye OEToolkits	1.5.0	c1ccc(cc1)NC(=O)c2cc[nH]n2
Canonical SMILES	CACTVS	3.341	O=C(Nc1ccccc1)c2cc[nH]n2
Canonical SMILES	OpenEye OEToolkits	1.5.0	c1ccc(cc1)NC(=O)c2cc[nH]n2
InChI	InChI	1.03	InChI=1S/C10H9N3O/c14-10(9-6-7-11-13-9)12-8-4-2-1-3-5-8/h1-7H,(H,11,13)(H,12,14)
InChIKey	InChI	1.03	WMZYZYFPPQOFKY-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank ID	DB08135
Name	N-phenyl-1H-pyrazole-3-carboxamide
Groups	experimental
Synonyms	N-phenyl-1H-pyrazole-3-carboxamide

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Cyclin-dependent kinase 2	MENFQKVEKIGEGTYGVVYKARNKLTGEVVALKKIRLDTETEGVPSTAIR...	unknown

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682