General Information of the Compound
| Compound ID |
CP0443254
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| Compound Name |
4-(2-methyl-3-phenyl-3,4-dihydropyrazol-5-yl)phenol
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| Structure |
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| Formula |
C16H16N2O
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| Molecular Weight |
252.317
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| Canonical SMILES |
CN1N=C(CC1c1ccccc1)c1ccc(O)cc1
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| InChI |
InChI=1S/C16H16N2O/c1-18-16(13-5-3-2-4-6-13)11-15(17-18)12-7-9-14(19)10-8-12/h2-10,16,19H,11H2,1H3
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| InChIKey |
YSQRQGMZNLYUQZ-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