General Information of the Compound
| Compound ID |
CP0324453
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| Compound Name |
UNC10107962
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| Structure |
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| Formula |
C26H33N3O3
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| Molecular Weight |
435.568
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| Canonical SMILES |
CCOc1ccccc1N1CCCN(CCCCOc2ccc3ccc(=O)[nH]c3c2)CC1
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| InChI |
InChI=1S/C26H33N3O3/c1-2-31-25-9-4-3-8-24(25)29-16-7-15-28(17-18-29)14-5-6-19-32-22-12-10-21-11-13-26(30)27-23(21)20-22/h3-4,8-13,20H,2,5-7,14-19H2,1H3,(H,27,30)
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| InChIKey |
UAILOOIRJOOOAV-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