General Information of the Compound
| Compound ID |
CP0171457
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| Compound Name |
N-(5-Cyclohexyl-2-methoxyphenyl)-4-methyl-3-(3-(2-(methylamino)pyridin-4-yl)pyridin-2-yloxy)benzamide
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| Structure |
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| Formula |
C32H34N4O3
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| Molecular Weight |
522.649
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| Canonical SMILES |
CNc1cc(ccn1)-c1cccnc1Oc1cc(ccc1C)C(=O)Nc1cc(ccc1OC)C1CCCCC1
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| InChI |
InChI=1S/C32H34N4O3/c1-21-11-12-25(31(37)36-27-18-23(13-14-28(27)38-3)22-8-5-4-6-9-22)19-29(21)39-32-26(10-7-16-35-32)24-15-17-34-30(20-24)33-2/h7,10-20,22H,4-6,8-9H2,1-3H3,(H,33,34)(H,36,37)
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| InChIKey |
XKBVARCCCUFGJS-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