General Information of the Compound
| Compound ID |
CP0439019
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| Compound Name |
N-hydroxy-N-[3-[1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazol-3-yl]prop-2-ynyl]benzamide
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| Structure |
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| Formula |
C27H23N3O3
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| Molecular Weight |
437.499
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| Canonical SMILES |
COc1ccc(cc1)-n1nc(cc1-c1ccc(C)cc1)C#CCN(O)C(=O)c1ccccc1
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| InChI |
InChI=1S/C27H23N3O3/c1-20-10-12-21(13-11-20)26-19-23(28-30(26)24-14-16-25(33-2)17-15-24)9-6-18-29(32)27(31)22-7-4-3-5-8-22/h3-5,7-8,10-17,19,32H,18H2,1-2H3
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| InChIKey |
QUQGRRKQWCNRLX-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