General Information of the Compound
| Compound ID |
CP0459231
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| Compound Name |
1-[4-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]-3-[3-(trifluoromethyl)phenyl]urea
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| Structure |
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| Formula |
C24H21F3N4O
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| Molecular Weight |
438.453
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| Canonical SMILES |
Cn1c(CCc2ccc(NC(=O)Nc3cccc(c3)C(F)(F)F)cc2)nc2ccccc12
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| InChI |
InChI=1S/C24H21F3N4O/c1-31-21-8-3-2-7-20(21)30-22(31)14-11-16-9-12-18(13-10-16)28-23(32)29-19-6-4-5-17(15-19)24(25,26)27/h2-10,12-13,15H,11,14H2,1H3,(H2,28,29,32)
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| InChIKey |
CDVKXZZMXRYSNX-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