General Information of the Compound
| Compound ID |
CP0507502
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| Compound Name |
1-(3,7-dimethyl-1H-indazole-5-carbonyl)spiro[piperidine-4,2'-pyrano[3,2-b]pyridin]-4'(3'H)-one
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| Structure |
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| Formula |
C22H22N4O3
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| Molecular Weight |
390.443
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| Canonical SMILES |
Cc1n[nH]c2c(C)cc(cc12)C(=O)N1CCC2(CC1)CC(=O)c1ncccc1O2
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| InChI |
InChI=1S/C22H22N4O3/c1-13-10-15(11-16-14(2)24-25-19(13)16)21(28)26-8-5-22(6-9-26)12-17(27)20-18(29-22)4-3-7-23-20/h3-4,7,10-11H,5-6,8-9,12H2,1-2H3,(H,24,25)
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| InChIKey |
OBACUGDWDKRTLR-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