General Information of the Compound
| Compound ID |
CP0909768
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| Compound Name |
4-((6-chloropyridin-3-yl)methyl)-1-hydroxy-N-((1S,2S)-2-hydroxycyclohexyl)-2-naphthamide
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| Structure |
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| Formula |
C23H23ClN2O3
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| Molecular Weight |
410.901
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| Canonical SMILES |
O=C(N[C@H]1CCCC[C@@H]1O)c1cc(Cc2ccc(Cl)nc2)c2ccccc2c1O
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| InChI |
InChI=1S/C23H23ClN2O3/c24-21-10-9-14(13-25-21)11-15-12-18(22(28)17-6-2-1-5-16(15)17)23(29)26-19-7-3-4-8-20(19)27/h1-2,5-6,9-10,12-13,19-20,27-28H,3-4,7-8,11H2,(H,26,29)/t19-,20-/m0/s1
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| InChIKey |
XZHOYJLUXYPRMQ-PMACEKPBSA-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