General Information of the Compound
| Compound ID |
CP0946534
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| Compound Name |
1-(4-sec-Butyl-phenyl)-5-(4-isopropyl-phenyl)-imidazolidin-(2Z)-ylideneamine hydrobromide
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| Structure |
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| Formula |
C22H30BrN3
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| Molecular Weight |
416.407
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| Canonical SMILES |
Br.CCC(C)c1ccc(N2C(N)=NCC2c2ccc(C(C)C)cc2)cc1
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| InChI |
InChI=1S/C22H29N3.BrH/c1-5-16(4)18-10-12-20(13-11-18)25-21(14-24-22(25)23)19-8-6-17(7-9-19)15(2)3;/h6-13,15-16,21H,5,14H2,1-4H3,(H2,23,24);1H
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| InChIKey |
FWACONMGQDMPGA-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