General Information of the Compound
| Compound ID |
CP0430751
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| Compound Name |
1-[3-(2-hydroxyphenyl)-5-methyl-3,4-dihydropyrazol-2-yl]-2-(4-methylpiperidin-1-yl)ethanone
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| Structure |
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| Formula |
C18H25N3O2
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| Molecular Weight |
315.417
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| Canonical SMILES |
CC1CCN(CC(=O)N2N=C(C)CC2c2ccccc2O)CC1
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| InChI |
InChI=1S/C18H25N3O2/c1-13-7-9-20(10-8-13)12-18(23)21-16(11-14(2)19-21)15-5-3-4-6-17(15)22/h3-6,13,16,22H,7-12H2,1-2H3
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| InChIKey |
CDWKNMUWYXGYDD-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