General Information of the Compound
| Compound ID |
CP0543741
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| Compound Name |
1-[4-[2-(1H-benzimidazol-2-yl)ethyl]phenyl]-3-(5-chloro-2-methoxyphenyl)urea
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| Structure |
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| Formula |
C23H21ClN4O2
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| Molecular Weight |
420.9
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| Canonical SMILES |
COc1ccc(Cl)cc1NC(=O)Nc1ccc(CCc2nc3ccccc3[nH]2)cc1
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| InChI |
InChI=1S/C23H21ClN4O2/c1-30-21-12-9-16(24)14-20(21)28-23(29)25-17-10-6-15(7-11-17)8-13-22-26-18-4-2-3-5-19(18)27-22/h2-7,9-12,14H,8,13H2,1H3,(H,26,27)(H2,25,28,29)
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| InChIKey |
IAYVYAYQWFWVDF-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