CMZ

(2S)-1-(2,5-dimethylphenoxy)-3-morpholin-4-ylpropan-2-ol

Created:	2007-07-16
Last modified:	2020-06-05

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1 entries where CMZ is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	42
Chiral Atom Count	1
Bond Count	43
Aromatic Bond Count	6

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Chemical Component Summary
Name	(2S)-1-(2,5-dimethylphenoxy)-3-morpholin-4-ylpropan-2-ol
Synonyms	(S)-1-(2,5-dimethylphenoxy)-3-morpholinopropan-2-ol
Systematic Name (OpenEye OEToolkits)	(2S)-1-(2,5-dimethylphenoxy)-3-morpholin-4-yl-propan-2-ol
Formula	C₁₅ H₂₃ N O₃
Molecular Weight	265.348
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	OC(CN1CCOCC1)COc2cc(ccc2C)C
SMILES	CACTVS	3.341	Cc1ccc(C)c(OC[CH](O)CN2CCOCC2)c1
SMILES	OpenEye OEToolkits	1.5.0	Cc1ccc(c(c1)OCC(CN2CCOCC2)O)C
Canonical SMILES	CACTVS	3.341	Cc1ccc(C)c(OC[C@@H](O)CN2CCOCC2)c1
Canonical SMILES	OpenEye OEToolkits	1.5.0	Cc1ccc(c(c1)OC[C@H](CN2CCOCC2)O)C
InChI	InChI	1.03	InChI=1S/C15H23NO3/c1-12-3-4-13(2)15(9-12)19-11-14(17)10-16-5-7-18-8-6-16/h3-4,9,14,17H,5-8,10-11H2,1-2H3/t14-/m0/s1
InChIKey	InChI	1.03	HVMGGHDPXHODHE-AWEZNQCLSA-N

Drug Info: DrugBank

DrugBank ID	DB07573
Name	(2S)-1-(2,5-dimethylphenoxy)-3-morpholin-4-ylpropan-2-ol
Groups	experimental
Synonyms	(2S)-1-(2,5-dimethylphenoxy)-3-morpholin-4-ylpropan-2-ol

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Beta-secretase 1	MAQALPWLLLWMGAGVLPAHGTQHGIRLPLRSGLGGAPLGLRLPRETDEE...	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