General Information of the Compound
| Compound ID |
CP0416665
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| Compound Name |
1-(1H-indazol-6-yl)-6-[2-(pyridin-4-ylmethyl)pyrazol-3-yl]benzotriazole
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| Structure |
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| Formula |
C22H16N8
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| Molecular Weight |
392.426
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| Canonical SMILES |
C(c1ccncc1)n1nccc1-c1ccc2nnn(-c3ccc4cn[nH]c4c3)c2c1
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| InChI |
InChI=1S/C22H16N8/c1-3-18(12-20-17(1)13-24-26-20)30-22-11-16(2-4-19(22)27-28-30)21-7-10-25-29(21)14-15-5-8-23-9-6-15/h1-13H,14H2,(H,24,26)
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| InChIKey |
FCBMWKSUZYVRLD-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