General Information of the Compound
| Compound ID |
CP0000947
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| Compound Name |
3-(3-azabicyclo[3.3.1]non-6-en-7-yl)pyridine-4-carbonitrile
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| Structure |
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| Formula |
C14H15N3
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| Molecular Weight |
225.295
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| Canonical SMILES |
N#Cc1ccncc1C1=CC2CNCC(C2)C1
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| InChI |
InChI=1S/C14H15N3/c15-6-12-1-2-16-9-14(12)13-4-10-3-11(5-13)8-17-7-10/h1-2,4,9-11,17H,3,5,7-8H2
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| InChIKey |
CHUVPNWRFUBJRL-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