General Information of the Compound
| Compound ID |
CP0513012
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| Compound Name |
7-[2,6-dimethoxy-4-(methoxymethyl)phenyl]-2-ethyl-N-(oxan-4-ylmethyl)-N-propylpyrazolo[1,5-a]pyridin-3-amine
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| Structure |
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| Formula |
C28H39N3O4
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| Molecular Weight |
481.637
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| Canonical SMILES |
CCCN(CC1CCOCC1)c1c(CC)nn2c(cccc12)-c1c(OC)cc(COC)cc1OC
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| InChI |
InChI=1S/C28H39N3O4/c1-6-13-30(18-20-11-14-35-15-12-20)28-22(7-2)29-31-23(9-8-10-24(28)31)27-25(33-4)16-21(19-32-3)17-26(27)34-5/h8-10,16-17,20H,6-7,11-15,18-19H2,1-5H3
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| InChIKey |
PVUJVRIUAZEDLP-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