General Information of the Compound
| Compound ID |
CP0475511
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| Compound Name |
1-[3-(2-hydroxyphenyl)-5-methyl-3,4-dihydropyrazol-2-yl]-2-(4-methylpiperazin-1-yl)ethanone
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| Structure |
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| Formula |
C17H24N4O2
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| Molecular Weight |
316.405
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| Canonical SMILES |
CN1CCN(CC(=O)N2N=C(C)CC2c2ccccc2O)CC1
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| InChI |
InChI=1S/C17H24N4O2/c1-13-11-15(14-5-3-4-6-16(14)22)21(18-13)17(23)12-20-9-7-19(2)8-10-20/h3-6,15,22H,7-12H2,1-2H3
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| InChIKey |
CIHPSVQRMBWAEQ-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