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PHN : Summary
Code ![](/pdbe/static/images/help.png)
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PHN
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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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1,10-PHENANTHROLINE
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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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C12 H8 N2
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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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180.205 Da
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SMILES ![](/pdbe/static/images/help.png)
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Type | Program | Version | Descriptor |
SMILES
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ACDLabs |
10.04 |
n1c3c(ccc1)ccc2cccnc23 |
SMILES
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CACTVS |
3.341 |
c1cnc2c(c1)ccc3cccnc23 |
SMILES
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OpenEye OEToolkits |
1.5.0 |
c1cc2ccc3cccnc3c2nc1 |
Canonical SMILES
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CACTVS |
3.341 |
c1cnc2c(c1)ccc3cccnc23 |
Canonical SMILES
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OpenEye OEToolkits |
1.5.0 |
c1cc2ccc3cccnc3c2nc1 |
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IUPAC InChI ![](/pdbe/static/images/help.png) | InChI=1S/C12H8N2/c1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1/h1-8H |
IUPAC InChI key ![](/pdbe/static/images/help.png) | DGEZNRSVGBDHLK-UHFFFAOYSA-N |
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wwPDB Information |
Atom count ![](/pdbe/static/images/help.png)
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22 (14 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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1999-07-08
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Last modified at ![](/pdbe/static/images/help.png)
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2011-06-04
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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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