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A1H4L : Summary
Code ![](/pdbe/static/images/help.png)
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A1H4L
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One-letter code ![](/pdbe/static/images/help.png)
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X
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Molecule name ![](/pdbe/static/images/help.png)
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1H-pyrrolo[3,2-b]pyridin-5-amine
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Systematic names ![](/pdbe/static/images/help.png)
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Formula ![](/pdbe/static/images/help.png)
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C7 H7 N3
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Formal charge ![](/pdbe/static/images/help.png)
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0
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Molecular weight ![](/pdbe/static/images/help.png)
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133.151 Da
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SMILES ![](/pdbe/static/images/help.png)
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Type | Program | Version | Descriptor |
SMILES
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CACTVS |
3.385 |
Nc1ccc2[nH]ccc2n1 |
SMILES
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OpenEye OEToolkits |
2.0.7 |
c1cc(nc2c1[nH]cc2)N |
Canonical SMILES
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CACTVS |
3.385 |
Nc1ccc2[nH]ccc2n1 |
Canonical SMILES
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OpenEye OEToolkits |
2.0.7 |
c1cc(nc2c1[nH]cc2)N |
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IUPAC InChI ![](/pdbe/static/images/help.png) | InChI=1S/C7H7N3/c8-7-2-1-5-6(10-7)3-4-9-5/h1-4,9H,(H2,8,10) |
IUPAC InChI key ![](/pdbe/static/images/help.png) | NOEYQOAKBMZXFX-UHFFFAOYSA-N |
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wwPDB Information |
Atom count ![](/pdbe/static/images/help.png)
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17 (10 without Hydrogen)
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Polymer type ![](/pdbe/static/images/help.png)
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Bound ligand
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Type description ![](/pdbe/static/images/help.png)
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non-polymer
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Type code ![](/pdbe/static/images/help.png)
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HETAIN
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Is modified ![](/pdbe/static/images/help.png)
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No
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Standard parent ![](/pdbe/static/images/help.png)
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Not Assigned
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Defined at ![](/pdbe/static/images/help.png)
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2024-02-15
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Last modified at ![](/pdbe/static/images/help.png)
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2024-03-15
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Status ![](/pdbe/static/images/help.png)
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Released
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Obsoleted ![](/pdbe/static/images/help.png)
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Not Assigned
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