General Information of the Compound
| Compound ID |
CP0415832
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| Compound Name |
6-[4-(2,3-dihydro-1,4-benzodioxin-6-yloxy)piperidin-1-yl]-5-methyl-N-(pyridin-4-ylmethyl)pyridazine-3-carboxamide
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| Structure |
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| Formula |
C25H27N5O4
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| Molecular Weight |
461.522
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| Canonical SMILES |
Cc1cc(nnc1N1CCC(CC1)Oc1ccc2OCCOc2c1)C(=O)NCc1ccncc1
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| InChI |
InChI=1S/C25H27N5O4/c1-17-14-21(25(31)27-16-18-4-8-26-9-5-18)28-29-24(17)30-10-6-19(7-11-30)34-20-2-3-22-23(15-20)33-13-12-32-22/h2-5,8-9,14-15,19H,6-7,10-13,16H2,1H3,(H,27,31)
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| InChIKey |
FPUAAXYCFWVNCX-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