General Information of the Compound
| Compound ID |
CP0916373
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| Compound Name |
7-(3,4-dichlorophenyl)-5-methyl-6-(1-methyl-5-(methylsulfonyl)-1H-benzo[d]imidazol-2-yl)-4,7-dihydropyrazolo[1,5-a]pyrimidine
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| Structure |
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| Formula |
C22H19Cl2N5O2S
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| Molecular Weight |
488.4
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| Canonical SMILES |
CC1=C(c2nc3cc(S(C)(=O)=O)ccc3n2C)C(c2ccc(Cl)c(Cl)c2)n2nccc2N1
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| InChI |
InChI=1S/C22H19Cl2N5O2S/c1-12-20(22-27-17-11-14(32(3,30)31)5-7-18(17)28(22)2)21(29-19(26-12)8-9-25-29)13-4-6-15(23)16(24)10-13/h4-11,21,26H,1-3H3
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| InChIKey |
GAYJRWLMPIATQS-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