General Information of the Compound
| Compound ID |
CP0074614
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| Compound Name |
4-(4-methylpiperazin-1-yl)-[1]benzofuro[3,2-d]pyrimidine
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| Structure |
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| Formula |
C15H16N4O
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| Molecular Weight |
268.32
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| Canonical SMILES |
CN1CCN(CC1)c1ncnc2c3ccccc3oc12
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| InChI |
InChI=1S/C15H16N4O/c1-18-6-8-19(9-7-18)15-14-13(16-10-17-15)11-4-2-3-5-12(11)20-14/h2-5,10H,6-9H2,1H3
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| InChIKey |
VWOBNWMZSJXLKD-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: PT01494, Beta-2 adrenergic receptor
Protein ID: PT01711, Histamine H4 receptor