General Information of the Compound
| Compound ID |
CP0381722
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| Compound Name |
4-(1H-imidazol-5-ylmethylidene)-1-(2-phenylethyl)piperidine
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| Structure |
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| Formula |
C17H21N3
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| Molecular Weight |
267.376
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| Canonical SMILES |
C(Cc1ccccc1)N1CCC(CC1)=Cc1c[nH]cn1
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| InChI |
InChI=1S/C17H21N3/c1-2-4-15(5-3-1)6-9-20-10-7-16(8-11-20)12-17-13-18-14-19-17/h1-5,12-14H,6-11H2,(H,18,19)
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| InChIKey |
DWKRHNOHHBZGFS-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