General Information of the Compound
| Compound ID |
CP0571673
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| Compound Name |
3-[4-[4-(3-methoxyphenyl)piperazin-1-yl]butyl]-1,3-benzoxazine-2,4-dione
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| Formula |
C23H27N3O4
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| Molecular Weight |
409.486
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| Canonical SMILES |
COc1cccc(c1)N1CCN(CCCCn2c(=O)oc3ccccc3c2=O)CC1
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| InChI |
InChI=1S/C23H27N3O4/c1-29-19-8-6-7-18(17-19)25-15-13-24(14-16-25)11-4-5-12-26-22(27)20-9-2-3-10-21(20)30-23(26)28/h2-3,6-10,17H,4-5,11-16H2,1H3
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| InChIKey |
UWQPVHXTQFWYAT-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