344

6-AMINO-3,7-DIHYDRO-IMIDAZO[4,5-G]QUINAZOLIN-8-ONE

Created:	2005-10-18
Last modified:	2011-06-04

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Chemical Details
Formal Charge	0
Atom Count	22
Chiral Atom Count	0
Bond Count	24
Aromatic Bond Count	15

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Chemical Component Summary
Name	6-AMINO-3,7-DIHYDRO-IMIDAZO[4,5-G]QUINAZOLIN-8-ONE
Systematic Name (OpenEye OEToolkits)	6-amino-3,7-dihydroimidazo[4,5-g]quinazolin-8-one
Formula	C₉ H₇ N₅ O
Molecular Weight	201.185
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=C1c3c(N=C(N)N1)cc2c(ncn2)c3
SMILES	CACTVS	3.341	NC1=Nc2cc3[nH]cnc3cc2C(=O)N1
SMILES	OpenEye OEToolkits	1.5.0	c1c2c(cc3c1nc[nH]3)N=C(NC2=O)N
Canonical SMILES	CACTVS	3.341	NC1=Nc2cc3[nH]cnc3cc2C(=O)N1
Canonical SMILES	OpenEye OEToolkits	1.5.0	c1c2c(cc3c1nc[nH]3)N=C(NC2=O)N
InChI	InChI	1.03	InChI=1S/C9H7N5O/c10-9-13-5-2-7-6(11-3-12-7)1-4(5)8(15)14-9/h1-3H,(H,11,12)(H3,10,13,14,15)
InChIKey	InChI	1.03	VQSMWFVKBKMHTO-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank ID	DB07012
Name	6-AMINO-3,7-DIHYDRO-IMIDAZO[4,5-G]QUINAZOLIN-8-ONE
Groups	experimental
Synonyms	6-AMINO-3,7-DIHYDRO-IMIDAZO[4,5-G]QUINAZOLIN-8-ONE

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Queuine tRNA-ribosyltransferase	MVEATAQETDRPRFSFSIAAREGKARTGTIEMKRGVIRTPAFMPVGTAAT...	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