General Information of the Compound
| Compound ID |
CP0468979
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| Compound Name |
1-[4-[2-(1H-benzimidazol-2-yl)ethyl]phenyl]-3-(3-bromophenyl)urea
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| Structure |
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| Formula |
C22H19BrN4O
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| Molecular Weight |
435.325
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| Canonical SMILES |
Brc1cccc(NC(=O)Nc2ccc(CCc3nc4ccccc4[nH]3)cc2)c1
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| InChI |
InChI=1S/C22H19BrN4O/c23-16-4-3-5-18(14-16)25-22(28)24-17-11-8-15(9-12-17)10-13-21-26-19-6-1-2-7-20(19)27-21/h1-9,11-12,14H,10,13H2,(H,26,27)(H2,24,25,28)
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| InChIKey |
XDYUXTZVWHBUFM-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