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PDBeChem : Molecule Descriptors
Molecule : AZG
Encodings of molecule in descriptor strings
Record | Name | Program | Version | Name |
1 |
InChI
|
InChI |
1.03 |
InChI=1S/C4H4N6O/c5-4-6-2-1(3(11)7-4)8-10-9-2/h(H4,5,6,7,8,9,10,11) |
2 |
InChIKey
|
InChI |
1.03 |
LPXQRXLUHJKZIE-UHFFFAOYSA-N |
3 |
SMILES
|
ACDLabs |
10.04 |
n1c(O)c2c(nc1N)nnn2 |
4 |
SMILES
|
CACTVS |
3.341 |
Nc1nc(O)c2[nH]nnc2n1 |
5 |
SMILES
|
OpenEye OEToolkits |
1.5.0 |
c12c(nc(nc1O)N)nn[nH]2 |
6 |
Canonical SMILES
|
CACTVS |
3.341 |
Nc1nc(O)c2[nH]nnc2n1 |
7 |
Canonical SMILES
|
OpenEye OEToolkits |
1.5.0 |
c12c(nc(nc1O)N)nn[nH]2 |
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