General Information of the Compound
| Compound ID |
CP0879783
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| Compound Name |
2-(7-(3,4-dichlorophenyl)-5-methyl-4,7-dihydropyrazolo[1,5-a]pyrimidin-6-yl)-1-methyl-1H-benzo[d]imidazole-5-carbonitrile
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| Structure |
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| Formula |
C22H16Cl2N6
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| Molecular Weight |
435.318
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| Canonical SMILES |
CC1=C(c2nc3cc(C#N)ccc3n2C)C(c2ccc(Cl)c(Cl)c2)n2nccc2N1
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| InChI |
InChI=1S/C22H16Cl2N6/c1-12-20(22-28-17-9-13(11-25)3-6-18(17)29(22)2)21(30-19(27-12)7-8-26-30)14-4-5-15(23)16(24)10-14/h3-10,21,27H,1-2H3
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| InChIKey |
VUQWTXMZRMXJML-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