General Information of the Compound
| Compound ID |
CP0028944
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| Compound Name |
1-[4-[4-(7-amino-2-naphthalen-1-ylfuro[2,3-c]pyridin-4-yl)pyrazol-1-yl]piperidin-1-yl]ethanone
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| Structure |
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| Formula |
C27H25N5O2
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| Molecular Weight |
451.53
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| Canonical SMILES |
CC(=O)N1CCC(CC1)n1cc(cn1)-c1cnc(N)c2oc(cc12)-c1cccc2ccccc12
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| InChI |
InChI=1S/C27H25N5O2/c1-17(33)31-11-9-20(10-12-31)32-16-19(14-30-32)24-15-29-27(28)26-23(24)13-25(34-26)22-8-4-6-18-5-2-3-7-21(18)22/h2-8,13-16,20H,9-12H2,1H3,(H2,28,29)
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| InChIKey |
PYNBJKLUOZMGRV-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