General Information of the Compound
| Compound ID |
CP0513081
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| Compound Name |
9-Chloro-2-methyl-5-((1-methyl-4-phenyl-1H-imidazol-2-ylthio)methyl)pyrazolo[1,5-c]quinazoline
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| Structure |
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| Formula |
C22H18ClN5S
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| Molecular Weight |
419.941
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| Canonical SMILES |
Cc1cc2c3cc(Cl)ccc3nc(CSc3nc(cn3C)-c3ccccc3)n2n1
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| InChI |
InChI=1S/C22H18ClN5S/c1-14-10-20-17-11-16(23)8-9-18(17)24-21(28(20)26-14)13-29-22-25-19(12-27(22)2)15-6-4-3-5-7-15/h3-12H,13H2,1-2H3
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| InChIKey |
PJVOPXRHYVUORG-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