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6ZM : Summary
Code ![](/pdbe/static/images/help.png)
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6ZM
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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-{2-[(2,3-dihydro-1H-inden-2-yl)amino]-7,8-dihydropyrido[4,3-d]pyrimidin-6(5H)-yl}ethan-1-one
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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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C18 H20 N4 O
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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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308.378 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 |
C1N(C(=O)C)CCc4c1cnc(NC2Cc3c(C2)cccc3)n4 |
SMILES
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CACTVS |
3.385 |
CC(=O)N1CCc2nc(NC3Cc4ccccc4C3)ncc2C1 |
SMILES
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OpenEye OEToolkits |
2.0.5 |
CC(=O)N1CCc2c(cnc(n2)NC3Cc4ccccc4C3)C1 |
Canonical SMILES
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CACTVS |
3.385 |
CC(=O)N1CCc2nc(NC3Cc4ccccc4C3)ncc2C1 |
Canonical SMILES
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OpenEye OEToolkits |
2.0.5 |
CC(=O)N1CCc2c(cnc(n2)NC3Cc4ccccc4C3)C1 |
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IUPAC InChI ![](/pdbe/static/images/help.png) | InChI=1S/C18H20N4O/c1-12(23)22-7-6-17-15(11-22)10-19-18(21-17)20-16-8-13-4-2-3-5-14(13)9-16/h2-5,10,16H,6-9,11H2,1H3,(H,19,20,21) |
IUPAC InChI key ![](/pdbe/static/images/help.png) | YZUQRESBRMOGBQ-UHFFFAOYSA-N |
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wwPDB Information |
Atom count ![](/pdbe/static/images/help.png)
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43 (23 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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2016-08-01
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Last modified at ![](/pdbe/static/images/help.png)
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2016-08-05
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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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