T5V

pyrimidin-5-amine

Created:	2020-03-16
Last modified:	2020-03-25

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3 entries where T5V is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	12
Chiral Atom Count	0
Bond Count	12
Aromatic Bond Count	6

2D diagram of T5V

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Chemical Component Summary
Name	pyrimidin-5-amine
Systematic Name (OpenEye OEToolkits)	pyrimidin-5-amine
Formula	C₄ H₅ N₃
Molecular Weight	95.103
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	n1cncc(N)c1
SMILES	CACTVS	3.385	Nc1cncnc1
SMILES	OpenEye OEToolkits	2.0.7	c1c(cncn1)N
Canonical SMILES	CACTVS	3.385	Nc1cncnc1
Canonical SMILES	OpenEye OEToolkits	2.0.7	c1c(cncn1)N
InChI	InChI	1.03	InChI=1S/C4H5N3/c5-4-1-6-3-7-2-4/h1-3H,5H2
InChIKey	InChI	1.03	FVLAYJRLBLHIPV-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	344373
ChEBI	CHEBI:38619
CCDC/CSD	XAZKEP
COD	2207775

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.