General Information of the Compound
| Compound ID |
CP0255072
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| Compound Name |
4-Ethyl-5,6-dihydro-1H-pyridin-(2Z)-ylideneamine
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| Synonyms |
4-Ethyl-1,2,5,6-tetrahydropyridine-2-imine
4-Ethyl-5,6-dihydro-1H-pyridin-(2Z)-ylideneamine
AKOS006359116
BDBM50237936
CHEMBL260277
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| Structure |
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| Formula |
C7H12N2
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| Molecular Weight |
124.187
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| Canonical SMILES |
CCC1=CC(N)=NCC1
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| InChI |
InChI=1S/C7H12N2/c1-2-6-3-4-9-7(8)5-6/h5H,2-4H2,1H3,(H2,8,9)
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| InChIKey |
PZWTXXAVOPPTGW-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT01856, Nitric oxide synthase 3
Protein ID: PT01472, Nitric oxide synthase, inducible
Clinical Information about the Compound