General Information of the Compound
| Compound ID |
CP0000799
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| Compound Name |
3-pyridin-3-yl-3,7-diazabicyclo[3.3.1]nonane
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| Structure |
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| Formula |
C12H17N3
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| Molecular Weight |
203.289
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| Canonical SMILES |
C1NCC2CC1CN(C2)c1cccnc1
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| InChI |
InChI=1S/C12H17N3/c1-2-12(7-13-3-1)15-8-10-4-11(9-15)6-14-5-10/h1-3,7,10-11,14H,4-6,8-9H2
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| InChIKey |
QGPJNUIJAGMDMT-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