General Information of the Compound
| Compound ID |
CP0469121
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| Compound Name |
3-(2-chlorobenzyloxy)-2-(4-chlorophenyl)-2,6,7,9-tetrahydropyrano[4,3-b]pyrazolo[3,4-d]pyridine
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| Structure |
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| Formula |
C22H17Cl2N3O2
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| Molecular Weight |
426.303
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| Canonical SMILES |
Clc1ccc(cc1)-n1nc2c3COCCc3ncc2c1OCc1ccccc1Cl
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| InChI |
InChI=1S/C22H17Cl2N3O2/c23-15-5-7-16(8-6-15)27-22(29-12-14-3-1-2-4-19(14)24)17-11-25-20-9-10-28-13-18(20)21(17)26-27/h1-8,11H,9-10,12-13H2
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| InChIKey |
QWIODYKZVMUKJC-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