General Information of the Compound
| Compound ID |
CP0883125
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| Compound Name |
4-((6-chloropyridin-3-yl)methyl)-N-((1S,2S)-2-hydroxycyclohexyl)-1-methoxy-2-naphthamide
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| Structure |
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| Formula |
C24H25ClN2O3
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| Molecular Weight |
424.928
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| Canonical SMILES |
COc1c(C(=O)N[C@H]2CCCC[C@@H]2O)cc(Cc2ccc(Cl)nc2)c2ccccc12
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| InChI |
InChI=1S/C24H25ClN2O3/c1-30-23-18-7-3-2-6-17(18)16(12-15-10-11-22(25)26-14-15)13-19(23)24(29)27-20-8-4-5-9-21(20)28/h2-3,6-7,10-11,13-14,20-21,28H,4-5,8-9,12H2,1H3,(H,27,29)/t20-,21-/m0/s1
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| InChIKey |
FYFIPDAYWLZXRD-SFTDATJTSA-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