General Information of the Compound
| Compound ID |
CP0027277
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| Compound Name |
1-[4-[4-[7-amino-2-[2-(methoxymethyl)phenyl]furo[2,3-c]pyridin-4-yl]pyrazol-1-yl]piperidin-1-yl]ethanone
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| Structure |
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| Formula |
C25H27N5O3
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| Molecular Weight |
445.523
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| Canonical SMILES |
COCc1ccccc1-c1cc2c(cnc(N)c2o1)-c1cnn(c1)C1CCN(CC1)C(C)=O
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| InChI |
InChI=1S/C25H27N5O3/c1-16(31)29-9-7-19(8-10-29)30-14-18(12-28-30)22-13-27-25(26)24-21(22)11-23(33-24)20-6-4-3-5-17(20)15-32-2/h3-6,11-14,19H,7-10,15H2,1-2H3,(H2,26,27)
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| InChIKey |
QSZXCVNXZODORT-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