WUS

(5R)-2-methyl-4,5,6,7-tetrahydro-1H-benzimidazol-5-amine

Created:	2020-11-17
Last modified:	2020-11-25

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1 entries where WUS 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	5

2D diagram of WUS

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Chemical Component Summary
Name	(5R)-2-methyl-4,5,6,7-tetrahydro-1H-benzimidazol-5-amine
Systematic Name (OpenEye OEToolkits)	(5~{R})-2-methyl-4,5,6,7-tetrahydro-1~{H}-benzimidazol-5-amine
Formula	C₈ H₁₃ N₃
Molecular Weight	151.209
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	c12CC(CCc1nc(C)n2)N
SMILES	CACTVS	3.385	Cc1[nH]c2CC[CH](N)Cc2n1
SMILES	OpenEye OEToolkits	2.0.7	Cc1[nH]c2c(n1)CC(CC2)N
Canonical SMILES	CACTVS	3.385	Cc1[nH]c2CC[C@@H](N)Cc2n1
Canonical SMILES	OpenEye OEToolkits	2.0.7	Cc1[nH]c2c(n1)C[C@@H](CC2)N
InChI	InChI	1.03	InChI=1S/C8H13N3/c1-5-10-7-3-2-6(9)4-8(7)11-5/h6H,2-4,9H2,1H3,(H,10,11)/t6-/m1/s1
InChIKey	InChI	1.03	JGCNHPQMPGHGHT-ZCFIWIBFSA-N

Related Resource References

Resource Name	Reference
PubChem	96635921

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.