General Information of the Compound
| Compound ID |
CP0574383
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| Compound Name |
3-[5-[4-[3-(2-oxo-1,3-benzoxazol-3-yl)propyl]piperazin-1-yl]pentyl]-1,3-benzoxazol-2-one
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| Structure |
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| Formula |
C26H32N4O4
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| Molecular Weight |
464.566
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| Canonical SMILES |
O=c1oc2ccccc2n1CCCCCN1CCN(CCCn2c3ccccc3oc2=O)CC1
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| InChI |
InChI=1S/C26H32N4O4/c31-25-29(21-9-2-4-11-23(21)33-25)15-7-1-6-13-27-17-19-28(20-18-27)14-8-16-30-22-10-3-5-12-24(22)34-26(30)32/h2-5,9-12H,1,6-8,13-20H2
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| InChIKey |
DCOMNHZMYXKQAK-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