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PZA : Summary
Code
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PZA
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One-letter code
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X
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Molecule name
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PYRAZINE-2-CARBOXAMIDE
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Systematic names
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Formula
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C5 H5 N3 O
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Formal charge
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0
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Molecular weight
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123.113 Da
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SMILES
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Type | Program | Version | Descriptor |
SMILES
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ACDLabs |
10.04 |
O=C(N)c1nccnc1 |
SMILES
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CACTVS |
3.341 |
NC(=O)c1cnccn1 |
SMILES
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OpenEye OEToolkits |
1.5.0 |
c1cnc(cn1)C(=O)N |
Canonical SMILES
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CACTVS |
3.341 |
NC(=O)c1cnccn1 |
Canonical SMILES
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OpenEye OEToolkits |
1.5.0 |
c1cnc(cn1)C(=O)N |
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IUPAC InChI | InChI=1S/C5H5N3O/c6-5(9)4-3-7-1-2-8-4/h1-3H,(H2,6,9) |
IUPAC InChI key | IPEHBUMCGVEMRF-UHFFFAOYSA-N |
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wwPDB Information |
Atom count
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14 (9 without Hydrogen)
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Polymer type
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Bound ligand
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Type description
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NON-POLYMER
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Type code
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HETAIN
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Is modified
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No
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Standard parent
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Not Assigned
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Defined at
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2004-09-06
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Last modified at
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2021-03-01
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Status
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Released
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Obsoleted
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Not Assigned
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