General Information of the Compound
| Compound ID |
CP0543744
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| Compound Name |
1-(3-acetylphenyl)-3-[4-[2-(1-ethylbenzimidazol-2-yl)ethyl]phenyl]urea
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| Structure |
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| Formula |
C26H26N4O2
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| Molecular Weight |
426.52
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| Canonical SMILES |
CCn1c(CCc2ccc(NC(=O)Nc3cccc(c3)C(C)=O)cc2)nc2ccccc12
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| InChI |
InChI=1S/C26H26N4O2/c1-3-30-24-10-5-4-9-23(24)29-25(30)16-13-19-11-14-21(15-12-19)27-26(32)28-22-8-6-7-20(17-22)18(2)31/h4-12,14-15,17H,3,13,16H2,1-2H3,(H2,27,28,32)
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| InChIKey |
XOAGHLARLVOCHO-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