General Information of the Compound
| Compound ID |
CP0450927
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| Compound Name |
N-[4-[[5-[3-(furan-2-ylmethyl)-4-oxoquinazolin-2-yl]-2-methoxyphenyl]methoxy]phenyl]acetamide
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| Structure |
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| Formula |
C29H25N3O5
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| Molecular Weight |
495.535
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| Canonical SMILES |
COc1ccc(cc1COc1ccc(NC(C)=O)cc1)-c1nc2ccccc2c(=O)n1Cc1ccco1
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| InChI |
InChI=1S/C29H25N3O5/c1-19(33)30-22-10-12-23(13-11-22)37-18-21-16-20(9-14-27(21)35-2)28-31-26-8-4-3-7-25(26)29(34)32(28)17-24-6-5-15-36-24/h3-16H,17-18H2,1-2H3,(H,30,33)
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| InChIKey |
YGBBRCWORXYFJA-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