General Information of the Compound
| Compound ID |
CP0038368
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| Compound Name |
4-[5-(2-methoxyethoxy)pyridin-3-yl]-5,13,18-triazatetracyclo[8.8.0.02,7.011,17]octadeca-1(10),2,4,6,8,11(17)-hexaen-12-one
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| Structure |
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| Formula |
C23H22N4O3
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| Molecular Weight |
402.454
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| Canonical SMILES |
COCCOc1cncc(c1)-c1cc2c3[nH]c4CCCNC(=O)c4c3ccc2cn1
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| InChI |
InChI=1S/C23H22N4O3/c1-29-7-8-30-16-9-15(11-24-13-16)20-10-18-14(12-26-20)4-5-17-21-19(27-22(17)18)3-2-6-25-23(21)28/h4-5,9-13,27H,2-3,6-8H2,1H3,(H,25,28)
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| InChIKey |
FZASNYXRGHCWCW-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