General Information of the Compound
| Compound ID |
CP0440166
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| Compound Name |
3-[(1Z)-1-[6-[(2-ethyl-5,7-dimethylimidazo[4,5-b]pyridin-3-yl)methyl]-2-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaenylidene]ethyl]-4H-1,2,4-oxadiazol-5-one
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| Structure |
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| Formula |
C30H29N5O2
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| Molecular Weight |
491.595
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| Canonical SMILES |
CCc1nc2c(C)cc(C)nc2n1Cc1ccc2c(CCc3ccccc3\C2=C(/C)c2noc(=O)[nH]2)c1
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| InChI |
InChI=1S/C30H29N5O2/c1-5-25-32-27-17(2)14-18(3)31-29(27)35(25)16-20-10-13-24-22(15-20)12-11-21-8-6-7-9-23(21)26(24)19(4)28-33-30(36)37-34-28/h6-10,13-15H,5,11-12,16H2,1-4H3,(H,33,34,36)/b26-19-
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| InChIKey |
WYGJUFNQDNBQMH-XHPQRKPJSA-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