General Information of the Compound
| Compound ID |
CP0548746
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| Compound Name |
1-(1H-indazol-6-yl)-6-[2-[(4-propan-2-ylphenyl)methyl]pyrazol-3-yl]benzotriazole
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| Structure |
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| Formula |
C26H23N7
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| Molecular Weight |
433.519
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| Canonical SMILES |
CC(C)c1ccc(Cn2nccc2-c2ccc3nnn(-c4ccc5cn[nH]c5c4)c3c2)cc1
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| InChI |
InChI=1S/C26H23N7/c1-17(2)19-5-3-18(4-6-19)16-32-25(11-12-28-32)20-8-10-23-26(13-20)33(31-30-23)22-9-7-21-15-27-29-24(21)14-22/h3-15,17H,16H2,1-2H3,(H,27,29)
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| InChIKey |
QZIMBHBKXOAONQ-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