General Information of the Compound
| Compound ID |
CP0412751
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| Compound Name |
ethyl 2-[3-(2-chlorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]-2-methyl-3-phenylpropanoate
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| Structure |
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| Formula |
C24H22ClN3O2
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| Molecular Weight |
419.912
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| Canonical SMILES |
CCOC(=O)C(C)(Cc1ccccc1)c1ccnc2c(cnn12)-c1ccccc1Cl
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| InChI |
InChI=1S/C24H22ClN3O2/c1-3-30-23(29)24(2,15-17-9-5-4-6-10-17)21-13-14-26-22-19(16-27-28(21)22)18-11-7-8-12-20(18)25/h4-14,16H,3,15H2,1-2H3
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| InChIKey |
LMLXWAXYSRKAEI-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