General Information of the Compound
| Compound ID |
CP0228397
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| Compound Name |
1-(2-(1H-imidazol-5-yl)ethyl)-3-(3,4-dichlorophenyl)urea
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| Structure |
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| Formula |
C12H12Cl2N4O
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| Molecular Weight |
299.161
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| Canonical SMILES |
Clc1ccc(NC(=O)NCCc2cnc[nH]2)cc1Cl
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| InChI |
InChI=1S/C12H12Cl2N4O/c13-10-2-1-8(5-11(10)14)18-12(19)16-4-3-9-6-15-7-17-9/h1-2,5-7H,3-4H2,(H,15,17)(H2,16,18,19)
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| InChIKey |
HPCOUHQWMCVIDR-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