General Information of the Compound
| Compound ID |
CP0508302
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| Compound Name |
5-Methyl-3-(phenylsulfonyl)-2-piperazin-1-yl-7,8-dihydro-6Hcyclopenta[e]pyrazolo[1,5-a]pyrimidine
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| Structure |
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| Formula |
C20H23N5O2S
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| Molecular Weight |
397.504
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| Canonical SMILES |
Cc1nc2c(c(nn2c2CCCc12)N1CCNCC1)S(=O)(=O)c1ccccc1
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| InChI |
InChI=1S/C20H23N5O2S/c1-14-16-8-5-9-17(16)25-19(22-14)18(20(23-25)24-12-10-21-11-13-24)28(26,27)15-6-3-2-4-7-15/h2-4,6-7,21H,5,8-13H2,1H3
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| InChIKey |
XOUNKJKURXCIHP-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