1Y5

(1R)-1,2,3,4-tetrahydronaphthalen-1-amine

Created:	2013-07-31
Last modified:	2013-08-07

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1 entries where 1Y5 is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	24
Chiral Atom Count	1
Bond Count	25
Aromatic Bond Count	6

2D diagram of 1Y5

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Chemical Component Summary
Name	(1R)-1,2,3,4-tetrahydronaphthalen-1-amine
Systematic Name (OpenEye OEToolkits)	(1R)-1,2,3,4-tetrahydronaphthalen-1-amine
Formula	C₁₀ H₁₃ N
Molecular Weight	147.217
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	c1ccc2c(c1)CCCC2N
SMILES	CACTVS	3.385	N[CH]1CCCc2ccccc12
SMILES	OpenEye OEToolkits	1.7.6	c1ccc2c(c1)CCCC2N
Canonical SMILES	CACTVS	3.385	N[C@@H]1CCCc2ccccc12
Canonical SMILES	OpenEye OEToolkits	1.7.6	c1ccc2c(c1)CCC[C@H]2N
InChI	InChI	1.03	InChI=1S/C10H13N/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-2,4,6,10H,3,5,7,11H2/t10-/m1/s1
InChIKey	InChI	1.03	JRZGPXSSNPTNMA-SNVBAGLBSA-N

Related Resource References

Resource Name	Reference
PubChem	7058072
ChEMBL	CHEMBL289966

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.