General Information of the Compound
| Compound ID |
CP0523700
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| Compound Name |
2-ethyl-1'-(7-ethyl-1H-indazole-5-carbonyl)-3-methylspiro[6H-pyrano[3,2-c]pyrazole-5,4'-piperidine]-7-one
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| Structure |
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| Formula |
C23H27N5O3
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| Molecular Weight |
421.501
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| Canonical SMILES |
CCc1cc(cc2cn[nH]c12)C(=O)N1CCC2(CC1)CC(=O)c1nn(CC)c(C)c1O2
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| InChI |
InChI=1S/C23H27N5O3/c1-4-15-10-16(11-17-13-24-25-19(15)17)22(30)27-8-6-23(7-9-27)12-18(29)20-21(31-23)14(3)28(5-2)26-20/h10-11,13H,4-9,12H2,1-3H3,(H,24,25)
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| InChIKey |
YZXXGBJLFVMSML-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