General Information of the Compound
| Compound ID |
CP0444754
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| Compound Name |
4-[3-(2,5-dichlorophenoxy)propyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-amine
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| Formula |
C17H22Cl2N6O
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| Molecular Weight |
397.31
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| Canonical SMILES |
CN1CCN(CC1)c1nc(N)nc(CCCOc2cc(Cl)ccc2Cl)n1
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| InChI |
InChI=1S/C17H22Cl2N6O/c1-24-6-8-25(9-7-24)17-22-15(21-16(20)23-17)3-2-10-26-14-11-12(18)4-5-13(14)19/h4-5,11H,2-3,6-10H2,1H3,(H2,20,21,22,23)
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| InChIKey |
OAYFFKDPUNMJMP-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
Protein ID: PT01354, 5-hydroxytryptamine receptor 6
Protein ID: PT00941, 5-hydroxytryptamine receptor 7
Protein ID: PT01005, D(2) dopamine receptor