General Information of the Compound
| Compound ID |
CP0426409
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| Compound Name |
1-(3-chloro-4-fluorophenyl)-3-[4-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]urea
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| Structure |
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| Formula |
C23H20ClFN4O
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| Molecular Weight |
422.891
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| Canonical SMILES |
Cn1c(CCc2ccc(NC(=O)Nc3ccc(F)c(Cl)c3)cc2)nc2ccccc12
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| InChI |
InChI=1S/C23H20ClFN4O/c1-29-21-5-3-2-4-20(21)28-22(29)13-8-15-6-9-16(10-7-15)26-23(30)27-17-11-12-19(25)18(24)14-17/h2-7,9-12,14H,8,13H2,1H3,(H2,26,27,30)
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| InChIKey |
VABKHQJNYFWKTR-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
Protein ID: PT01390, BDNF/NT-3 growth factors receptor
Protein ID: PT00934, High affinity nerve growth factor receptor