General Information of the Compound
| Compound ID |
CP0930788
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| Compound Name |
(7-(3,4-dichlorophenyl)-5-methyl-4,7-dihydropyrazolo[1,5-a]pyrimidin-6-yl)(2-(pyridin-3-yl)pyrrolidin-1-yl)methanone
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| Structure |
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| Formula |
C23H21Cl2N5O
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| Molecular Weight |
454.361
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| Canonical SMILES |
CC1=C(C(=O)N2CCCC2c2cccnc2)C(c2ccc(Cl)c(Cl)c2)n2nccc2N1
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| InChI |
InChI=1S/C23H21Cl2N5O/c1-14-21(23(31)29-11-3-5-19(29)16-4-2-9-26-13-16)22(30-20(28-14)8-10-27-30)15-6-7-17(24)18(25)12-15/h2,4,6-10,12-13,19,22,28H,3,5,11H2,1H3
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| InChIKey |
DGDQLDDRXYYINZ-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