General Information of the Compound
| Compound ID |
CP0537415
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| Compound Name |
4-(4-methylpiperazin-1-yl)-6-(1-phenoxypropyl)-1,3,5-triazin-2-amine
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| Formula |
C17H24N6O
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| Molecular Weight |
328.42
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| Canonical SMILES |
CCC(Oc1ccccc1)c1nc(N)nc(n1)N1CCN(C)CC1
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| InChI |
InChI=1S/C17H24N6O/c1-3-14(24-13-7-5-4-6-8-13)15-19-16(18)21-17(20-15)23-11-9-22(2)10-12-23/h4-8,14H,3,9-12H2,1-2H3,(H2,18,19,20,21)
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| InChIKey |
RGBWKRQKGURHQM-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