General Information of the Compound
| Compound ID |
CP0234360
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| Compound Name |
1-(1H-indazol-5-yl)-3-[2-(4-methoxyphenyl)ethyl]urea
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| Structure |
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| Formula |
C17H18N4O2
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| Molecular Weight |
310.357
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| Canonical SMILES |
COc1ccc(CCNC(=O)Nc2ccc3[nH]ncc3c2)cc1
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| InChI |
InChI=1S/C17H18N4O2/c1-23-15-5-2-12(3-6-15)8-9-18-17(22)20-14-4-7-16-13(10-14)11-19-21-16/h2-7,10-11H,8-9H2,1H3,(H,19,21)(H2,18,20,22)
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| InChIKey |
KJQBGORTXYGZGC-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