General Information of the Compound
| Compound ID |
CP0128727
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| Compound Name |
8-chloro-4-(4-methylpiperazin-1-yl)benzofuro[3,2-d]pyrimidine
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| Structure |
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| Formula |
C15H15ClN4O
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| Molecular Weight |
302.765
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| Canonical SMILES |
CN1CCN(CC1)c1ncnc2c3cc(Cl)ccc3oc12
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| InChI |
InChI=1S/C15H15ClN4O/c1-19-4-6-20(7-5-19)15-14-13(17-9-18-15)11-8-10(16)2-3-12(11)21-14/h2-3,8-9H,4-7H2,1H3
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| InChIKey |
VUWKQWOFKSEXGA-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