General Information of the Compound
| Compound ID |
CP0677385
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| Compound Name |
6-([1,2,4]triazolo[4,3-a]pyridin-5-yl)-2,2,4,4-tetramethyl-4,7,8,9-tetrahydro-1H-cyclopenta[h]quinolin-3(2H)-one
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| Structure |
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| Formula |
C22H24N4O
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| Molecular Weight |
360.461
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| Canonical SMILES |
CC1(C)Nc2c(cc(-c3cccc4nncn34)c3c2CCC3)C(C)(C)C1=O
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| InChI |
InChI=1S/C22H24N4O/c1-21(2)16-11-15(17-9-6-10-18-25-23-12-26(17)18)13-7-5-8-14(13)19(16)24-22(3,4)20(21)27/h6,9-12,24H,5,7-8H2,1-4H3
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| InChIKey |
KBFFQQCDKBTNHR-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