AX2

1,3,5-triazine-2,4,6-triamine

Created:	2007-12-20
Last modified:	2021-03-01

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3 entries where AX2 is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	15
Chiral Atom Count	0
Bond Count	15
Aromatic Bond Count	6

2D diagram of AX2

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Chemical Component Summary
Name	1,3,5-triazine-2,4,6-triamine
Synonyms	Melamine
Systematic Name (OpenEye OEToolkits)	1,3,5-triazine-2,4,6-triamine
Formula	C₃ H₆ N₆
Molecular Weight	126.12
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	n1c(nc(nc1N)N)N
SMILES	CACTVS	3.341	Nc1nc(N)nc(N)n1
SMILES	OpenEye OEToolkits	1.5.0	c1(nc(nc(n1)N)N)N
Canonical SMILES	CACTVS	3.341	Nc1nc(N)nc(N)n1
Canonical SMILES	OpenEye OEToolkits	1.5.0	c1(nc(nc(n1)N)N)N
InChI	InChI	1.03	InChI=1S/C3H6N6/c4-1-7-2(5)9-3(6)8-1/h(H6,4,5,6,7,8,9)
InChIKey	InChI	1.03	JDSHMPZPIAZGSV-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	7955, 135957090
ChEMBL	CHEMBL1231106
ChEBI	CHEBI:27915
CCDC/CSD	CANFUS, CIDDAV, DIBGIE, DEJNAK, DEJMUD, CATNES, AFABOZ, ETAZEF
COD	4029772, 7216830, 7217999, 2205105, 4516259, 4516261, 4516260

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.