General Information of the Compound
| Compound ID |
CP0421745
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| Compound Name |
4-chloro-6-[2-[(5-chloropyridin-2-yl)methyl]pyrazol-3-yl]-1-(1H-indazol-6-yl)benzotriazole
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| Structure |
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| Formula |
C22H14Cl2N8
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| Molecular Weight |
461.316
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| Canonical SMILES |
Clc1ccc(Cn2nccc2-c2cc(Cl)c3nnn(-c4ccc5cn[nH]c5c4)c3c2)nc1
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| InChI |
InChI=1S/C22H14Cl2N8/c23-15-2-3-16(25-11-15)12-31-20(5-6-27-31)14-7-18(24)22-21(8-14)32(30-29-22)17-4-1-13-10-26-28-19(13)9-17/h1-11H,12H2,(H,26,28)
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| InChIKey |
ZDOABTDZRAJXOA-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