General Information of the Compound
| Compound ID |
CP0453682
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| Compound Name |
(1H-Benzoimidazol-2-yl)-(8-chloro-1,2,3,4-tetrahydronaphthalen-1-yl)amine
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| Structure |
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| Formula |
C17H16ClN3
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| Molecular Weight |
297.789
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| Canonical SMILES |
Clc1cccc2CCCC(Nc3nc4ccccc4[nH]3)c12
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| InChI |
InChI=1S/C17H16ClN3/c18-12-7-3-5-11-6-4-10-15(16(11)12)21-17-19-13-8-1-2-9-14(13)20-17/h1-3,5,7-9,15H,4,6,10H2,(H2,19,20,21)
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| InChIKey |
JYVJZLHVBHWWNS-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