General Information of the Compound
| Compound ID |
CP0863943
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| Compound Name |
rac-(2-Chloro-7-(3,4-dichlorophenyl)-5-methyl-4,7-dihydropyrazolo-[1,5-a]pyrimidin-6-yl)(4-fluorophenylpiperazin-1-yl)methanone
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| Structure |
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| Formula |
C24H21Cl3FN5O
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| Molecular Weight |
520.823
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| Canonical SMILES |
CC1=C(C(=O)N2CCN(c3ccc(F)cc3)CC2)C(c2ccc(Cl)c(Cl)c2)n2nc(Cl)cc2N1
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| InChI |
InChI=1S/C24H21Cl3FN5O/c1-14-22(24(34)32-10-8-31(9-11-32)17-5-3-16(28)4-6-17)23(15-2-7-18(25)19(26)12-15)33-21(29-14)13-20(27)30-33/h2-7,12-13,23,29H,8-11H2,1H3
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| InChIKey |
JYILHKSCNIYPNP-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