General Information of the Compound
| Compound ID |
CP0426349
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| Compound Name |
4-(4-cyclopentylpiperazin-1-yl)-6-methoxy-7-(3-pyrrolidin-1-ylpropoxy)quinazoline
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| Structure |
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| Formula |
C25H37N5O2
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| Molecular Weight |
439.604
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| Canonical SMILES |
COc1cc2c(ncnc2cc1OCCCN1CCCC1)N1CCN(CC1)C1CCCC1
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| InChI |
InChI=1S/C25H37N5O2/c1-31-23-17-21-22(18-24(23)32-16-6-11-28-9-4-5-10-28)26-19-27-25(21)30-14-12-29(13-15-30)20-7-2-3-8-20/h17-20H,2-16H2,1H3
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| InChIKey |
BJEJSNGKVHUIRL-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