PH3

N-(CHLOROPHENYL)-N'-HYDROXYGUANIDINE

Created:	1999-12-16
Last modified:	2011-06-04

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1 entries where PH3 is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	20
Chiral Atom Count	0
Bond Count	20
Aromatic Bond Count	6

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Chemical Component Summary
Name	N-(CHLOROPHENYL)-N'-HYDROXYGUANIDINE
Systematic Name (OpenEye OEToolkits)	1-(4-chlorophenyl)-3-hydroxy-guanidine
Formula	C₇ H₈ Cl N₃ O
Molecular Weight	185.611
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	Clc1ccc(NC(=[N@H])NO)cc1
SMILES	CACTVS	3.341	ONC(=N)Nc1ccc(Cl)cc1
SMILES	OpenEye OEToolkits	1.5.0	c1cc(ccc1NC(=N)NO)Cl
Canonical SMILES	CACTVS	3.341	ONC(=N)Nc1ccc(Cl)cc1
Canonical SMILES	OpenEye OEToolkits	1.5.0	c1cc(ccc1NC(=N)NO)Cl
InChI	InChI	1.03	InChI=1S/C7H8ClN3O/c8-5-1-3-6(4-2-5)10-7(9)11-12/h1-4,12H,(H3,9,10,11)
InChIKey	InChI	1.03	JYBXKTLYOMPMQY-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank ID	DB04559
Name	N-(Chlorophenyl)-N'-hydroxyguanidine
Groups	experimental
Synonyms	N-(Chlorophenyl)-N'-hydroxyguanidine
CAS number	130974-86-6

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Nitric oxide synthase, endothelial	MGNLKSVAQEPGPPCGLGLGLGLGLCGKQGPATPAPEPSRAPASLLPPAP...	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