General Information of the Compound
| Compound ID |
CP0847031
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| Compound Name |
1,3-Bis-(4-sec-butyl-phenyl)-tetrahydro-pyrimidin-2-ylideneamine hydrobromide
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| Structure |
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| Formula |
C24H34BrN3
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| Molecular Weight |
444.461
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| Canonical SMILES |
Br.CCC(C)c1ccc(N2CCCN(c3ccc(C(C)CC)cc3)C2=N)cc1
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| InChI |
InChI=1S/C24H33N3.BrH/c1-5-18(3)20-8-12-22(13-9-20)26-16-7-17-27(24(26)25)23-14-10-21(11-15-23)19(4)6-2;/h8-15,18-19,25H,5-7,16-17H2,1-4H3;1H
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| InChIKey |
TZVSKNORFVSVPD-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