General Information of the Compound
| Compound ID |
CP0488743
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| Compound Name |
US9169224, 68
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| Structure |
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| Formula |
C28H25N3O
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| Molecular Weight |
419.528
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| Canonical SMILES |
O=C(Nc1ccccc1)N1CCN(Cc2ccc3ccc4cccc5ccc2c3c45)CC1
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| InChI |
InChI=1S/C28H25N3O/c32-28(29-24-7-2-1-3-8-24)31-17-15-30(16-18-31)19-23-12-11-22-10-9-20-5-4-6-21-13-14-25(23)27(22)26(20)21/h1-14H,15-19H2,(H,29,32)
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| InChIKey |
ULKPJSOZTZPHHP-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