General Information of the Compound
| Compound ID |
CP0560200
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| Compound Name |
1-[[5-tert-butyl-2-(3-chlorophenyl)pyrazol-3-yl]methyl]-3-(1-methylindazol-4-yl)urea
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| Formula |
C23H25ClN6O
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| Molecular Weight |
436.947
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| Canonical SMILES |
Cn1ncc2c(NC(=O)NCc3cc(nn3-c3cccc(Cl)c3)C(C)(C)C)cccc12
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| InChI |
InChI=1S/C23H25ClN6O/c1-23(2,3)21-12-17(30(28-21)16-8-5-7-15(24)11-16)13-25-22(31)27-19-9-6-10-20-18(19)14-26-29(20)4/h5-12,14H,13H2,1-4H3,(H2,25,27,31)
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| InChIKey |
FHMOLVNGVABXAJ-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