General Information of the Compound
| Compound ID |
CP0436019
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| Compound Name |
6-[[(5R)-2-(2,6-dimethylpyridin-4-yl)-2,7-diazaspiro[4.4]nonan-7-yl]methyl]quinoxaline
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| Structure |
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| Formula |
C23H27N5
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| Molecular Weight |
373.504
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| Canonical SMILES |
Cc1cc(cc(C)n1)N1CC[C@@]2(CCN(Cc3ccc4nccnc4c3)C2)C1
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| InChI |
InChI=1S/C23H27N5/c1-17-11-20(12-18(2)26-17)28-10-6-23(16-28)5-9-27(15-23)14-19-3-4-21-22(13-19)25-8-7-24-21/h3-4,7-8,11-13H,5-6,9-10,14-16H2,1-2H3/t23-/m1/s1
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| InChIKey |
KJUZVOMMESDTBC-HSZRJFAPSA-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