General Information of the Compound
| Compound ID |
CP0524142
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| Compound Name |
ethyl (2R)-2-[3-(4-chlorophenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-yl]-2-methyl-3-phenylpropanoate
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| Structure |
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| Formula |
C25H24ClN3O2
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| Molecular Weight |
433.939
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| Canonical SMILES |
CCOC(=O)[C@](C)(Cc1ccccc1)c1cc(C)nc2c(cnn12)-c1ccc(Cl)cc1
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| InChI |
InChI=1S/C25H24ClN3O2/c1-4-31-24(30)25(3,15-18-8-6-5-7-9-18)22-14-17(2)28-23-21(16-27-29(22)23)19-10-12-20(26)13-11-19/h5-14,16H,4,15H2,1-3H3/t25-/m1/s1
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| InChIKey |
UUKJPPZEZJGKHC-RUZDIDTESA-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