General Information of the Compound
| Compound ID |
CP0375845
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| Compound Name |
N-(cyclopropylmethyl)-7-[2,6-dimethoxy-4-(methoxymethyl)phenyl]-N-(1,4-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)CC3COCCO3)c(SC)nn12
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| InChI |
InChI=1S/C27H35N3O5S/c1-31-16-19-12-23(32-2)25(24(13-19)33-3)21-6-5-7-22-26(27(36-4)28-30(21)22)29(14-18-8-9-18)15-20-17-34-10-11-35-20/h5-7,12-13,18,20H,8-11,14-17H2,1-4H3
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| InChIKey |
AQWYSBBQJKLCHB-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