General Information of the Compound
| Compound ID |
CP0437618
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| Compound Name |
1-hydroxy-1-[1-[1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazol-3-yl]pent-1-yn-3-yl]urea
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| Structure |
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| Formula |
C23H24N4O3
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| Molecular Weight |
404.47
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| Canonical SMILES |
CCC(C#Cc1cc(-c2ccc(C)cc2)n(n1)-c1ccc(OC)cc1)N(O)C(N)=O
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| InChI |
InChI=1S/C23H24N4O3/c1-4-19(27(29)23(24)28)10-9-18-15-22(17-7-5-16(2)6-8-17)26(25-18)20-11-13-21(30-3)14-12-20/h5-8,11-15,19,29H,4H2,1-3H3,(H2,24,28)
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| InChIKey |
IZWFCWFUHBKUSC-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