General Information of the Compound
| Compound ID |
CP0536525
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| Compound Name |
1-[4-[2-(1-ethylbenzimidazol-2-yl)ethyl]phenyl]-3-(3,4,5-trimethoxyphenyl)urea
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| Structure |
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| Formula |
C27H30N4O4
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| Molecular Weight |
474.561
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| Canonical SMILES |
CCn1c(CCc2ccc(NC(=O)Nc3cc(OC)c(OC)c(OC)c3)cc2)nc2ccccc12
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| InChI |
InChI=1S/C27H30N4O4/c1-5-31-22-9-7-6-8-21(22)30-25(31)15-12-18-10-13-19(14-11-18)28-27(32)29-20-16-23(33-2)26(35-4)24(17-20)34-3/h6-11,13-14,16-17H,5,12,15H2,1-4H3,(H2,28,29,32)
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| InChIKey |
BODHVMZIORVMSR-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