General Information of the Compound
| Compound ID |
CP0242631
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| Compound Name |
5-bromo-2-[3-(piperidin-2-ylmethyl)imidazol-4-yl]-1H-indole
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| Structure |
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| Formula |
C17H19BrN4
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| Molecular Weight |
359.271
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| Canonical SMILES |
Brc1ccc2[nH]c(cc2c1)-c1cncn1CC1CCCCN1
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| InChI |
InChI=1S/C17H19BrN4/c18-13-4-5-15-12(7-13)8-16(21-15)17-9-19-11-22(17)10-14-3-1-2-6-20-14/h4-5,7-9,11,14,20-21H,1-3,6,10H2
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| InChIKey |
KAKIPBBHSOKMEY-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