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L07 : Summary
Code ![](/pdbe/static/images/help.png)
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L07
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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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2-propyl[1,3]thiazolo[4,5-c]quinolin-4-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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C13 H13 N3 S
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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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243.327 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 |
12.01 |
n2c1ccccc1c3sc(nc3c2N)CCC |
SMILES
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CACTVS |
3.370 |
CCCc1sc2c3ccccc3nc(N)c2n1 |
SMILES
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OpenEye OEToolkits |
1.7.6 |
CCCc1nc2c(s1)c3ccccc3nc2N |
Canonical SMILES
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CACTVS |
3.370 |
CCCc1sc2c3ccccc3nc(N)c2n1 |
Canonical SMILES
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OpenEye OEToolkits |
1.7.6 |
CCCc1nc2c(s1)c3ccccc3nc2N |
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IUPAC InChI ![](/pdbe/static/images/help.png) | InChI=1S/C13H13N3S/c1-2-5-10-16-11-12(17-10)8-6-3-4-7-9(8)15-13(11)14/h3-4,6-7H,2,5H2,1H3,(H2,14,15) |
IUPAC InChI key ![](/pdbe/static/images/help.png) | NFYMGJSUKCDVJR-UHFFFAOYSA-N |
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wwPDB Information |
Atom count ![](/pdbe/static/images/help.png)
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30 (17 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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2013-01-22
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Last modified at ![](/pdbe/static/images/help.png)
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2021-03-13
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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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