GZ2

3-(1H-tetrazol-5-ylamino)cyclohex-2-en-1-one

Created:	2009-02-03
Last modified:	2011-06-04

Find Related PDB Entry
1 entries where GZ2 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	22
Chiral Atom Count	0
Bond Count	23
Aromatic Bond Count	5

Toggle Hydrogen Toggle Labels

Chemical Component Summary
Name	3-(1H-tetrazol-5-ylamino)cyclohex-2-en-1-one
Systematic Name (OpenEye OEToolkits)	3-(1H-1,2,3,4-tetrazol-5-ylamino)cyclohex-2-en-1-one
Formula	C₇ H₉ N₅ O
Molecular Weight	179.179
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=C2C=C(Nc1nnnn1)CCC2
SMILES	CACTVS	3.341	O=C1CCCC(=C1)Nc2[nH]nnn2
SMILES	OpenEye OEToolkits	1.5.0	C1CC(=CC(=O)C1)Nc2[nH]nnn2
Canonical SMILES	CACTVS	3.341	O=C1CCCC(=C1)Nc2[nH]nnn2
Canonical SMILES	OpenEye OEToolkits	1.5.0	C1CC(=CC(=O)C1)Nc2[nH]nnn2
InChI	InChI	1.03	InChI=1S/C7H9N5O/c13-6-3-1-2-5(4-6)8-7-9-11-12-10-7/h4H,1-3H2,(H2,8,9,10,11,12)
InChIKey	InChI	1.03	REZXFQGPXQJVJG-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank ID	DB07865
Name	3-(1H-tetrazol-5-ylamino)cyclohex-2-en-1-one
Groups	experimental
Synonyms	3-(1H-tetrazol-5-ylamino)cyclohex-2-en-1-one

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Beta-lactamase	MVTKRVQRMMFAAAACIPLLLGSAPLYAQTSAVQQKLAALEKSSGGRLGV...	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