General Information of the Compound
| Compound ID |
CP0407721
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| Compound Name |
2-methyl-3-(3-methylphenyl)-5-phenyl-3,4-dihydropyrazole
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| Structure |
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| Formula |
C17H18N2
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| Molecular Weight |
250.345
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| Canonical SMILES |
CN1N=C(CC1c1cccc(C)c1)c1ccccc1
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| InChI |
InChI=1S/C17H18N2/c1-13-7-6-10-15(11-13)17-12-16(18-19(17)2)14-8-4-3-5-9-14/h3-11,17H,12H2,1-2H3
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| InChIKey |
RKTXLCSBVLATFE-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