General Information of the Compound
| Compound ID |
CP0424521
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| Compound Name |
N-(cyclopropylmethyl)-7-[2,6-dimethoxy-4-(methoxymethyl)phenyl]-N-(1,3-dioxan-2-ylmethyl)-2-methylsulfanylpyrazolo[1,5-a]pyridin-3-amine
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| Structure |
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| Formula |
C27H35N3O5S
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| Molecular Weight |
513.66
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| Canonical SMILES |
COCc1cc(OC)c(c(OC)c1)-c1cccc2c(N(CC3CC3)CC3OCCCO3)c(SC)nn12
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| InChI |
InChI=1S/C27H35N3O5S/c1-31-17-19-13-22(32-2)25(23(14-19)33-3)20-7-5-8-21-26(27(36-4)28-30(20)21)29(15-18-9-10-18)16-24-34-11-6-12-35-24/h5,7-8,13-14,18,24H,6,9-12,15-17H2,1-4H3
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| InChIKey |
LWARJBUQGSWSAQ-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