General Information of the Compound
| Compound ID |
CP0383791
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| Compound Name |
3-(3-methoxyphenyl)-7-(4-(8-methyl-3,8-diazabicyclo[3.2.1]octan-3-yl)phenyl)-2-(pyridin-4-yl)pyrazolo[1,5-a]pyrimidine
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| Structure |
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| Formula |
C31H30N6O
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| Molecular Weight |
502.622
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| Canonical SMILES |
COc1cccc(c1)-c1c(nn2c(ccnc12)-c1ccc(cc1)N1CC2CCC(C1)N2C)-c1ccncc1
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| InChI |
InChI=1S/C31H30N6O/c1-35-25-10-11-26(35)20-36(19-25)24-8-6-21(7-9-24)28-14-17-33-31-29(23-4-3-5-27(18-23)38-2)30(34-37(28)31)22-12-15-32-16-13-22/h3-9,12-18,25-26H,10-11,19-20H2,1-2H3
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| InChIKey |
FKRUTODYQQBSGD-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