General Information of the Compound
| Compound ID |
CP0969155
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| Compound Name |
3-(4,4-difluorocyclohex-1-en-1-yl)-5-methyl-2-phenyl-6-(quinolin-6-yl)pyrazolo[1,5-a]pyrimidin-7(4H)-one
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| Formula |
C28H22F2N4O
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| Molecular Weight |
468.507
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| Canonical SMILES |
Cc1[nH]c2c(C3=CCC(F)(F)CC3)c(-c3ccccc3)nn2c(=O)c1-c1ccc2ncccc2c1
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| InChI |
InChI=1S/C28H22F2N4O/c1-17-23(21-9-10-22-20(16-21)8-5-15-31-22)27(35)34-26(32-17)24(18-11-13-28(29,30)14-12-18)25(33-34)19-6-3-2-4-7-19/h2-11,15-16,32H,12-14H2,1H3
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| InChIKey |
WVBGRSPBKYBBIT-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