General Information of the Compound
| Compound ID |
CP0504322
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| Compound Name |
1'-(7-ethyl-1H-indazole-5-carbonyl)-5-methoxyspiro[chroman-2,4'-piperidin]-4-one
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| Structure |
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| Formula |
C24H25N3O4
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| Molecular Weight |
419.481
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| Canonical SMILES |
CCc1cc(cc2cn[nH]c12)C(=O)N1CCC2(CC1)CC(=O)c1c(OC)cccc1O2
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| InChI |
InChI=1S/C24H25N3O4/c1-3-15-11-16(12-17-14-25-26-22(15)17)23(29)27-9-7-24(8-10-27)13-18(28)21-19(30-2)5-4-6-20(21)31-24/h4-6,11-12,14H,3,7-10,13H2,1-2H3,(H,25,26)
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| InChIKey |
WNWMBBOWDDUFOF-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