General Information of the Compound
| Compound ID |
CP0575687
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| Compound Name |
US10668051, Compound Example 19
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| Structure |
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| Formula |
C23H23N3O
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| Molecular Weight |
357.457
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| Canonical SMILES |
O=C(Cc1ccccc1)Nc1ccc(cc1)-n1nc(cc1C1CC1)C1CC1
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| InChI |
InChI=1S/C23H23N3O/c27-23(14-16-4-2-1-3-5-16)24-19-10-12-20(13-11-19)26-22(18-8-9-18)15-21(25-26)17-6-7-17/h1-5,10-13,15,17-18H,6-9,14H2,(H,24,27)
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| InChIKey |
OUJQSLUNDPQAFU-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