MJB

2-piperazin-1-ylethanol

Created:	2019-10-15
Last modified:	2020-10-14

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1 entries where MJB is found as a standalone ligand

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

2D diagram of MJB

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Chemical Component Summary
Name	2-piperazin-1-ylethanol
Systematic Name (OpenEye OEToolkits)	2-piperazin-1-ylethanol
Formula	C₆ H₁₄ N₂ O
Molecular Weight	130.188
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	OCCN1CCNCC1
SMILES	OpenEye OEToolkits	2.0.7	C1CN(CCN1)CCO
Canonical SMILES	CACTVS	3.385	OCCN1CCNCC1
Canonical SMILES	OpenEye OEToolkits	2.0.7	C1CN(CCN1)CCO
InChI	InChI	1.03	InChI=1S/C6H14N2O/c9-6-5-8-3-1-7-2-4-8/h7,9H,1-6H2
InChIKey	InChI	1.03	WFCSWCVEJLETKA-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	7677
ChEMBL	CHEMBL3183736
CCDC/CSD	VAXRIY, JULTUH, VOSSAZ, XEYHOB, JULTOB, JULTIV, DIDHAB, WIRROE, YOMWII, DUJKOK, APOWUZ, YOMPEX, LETZAN, CUHTIL

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.