General Information of the Compound
| Compound ID |
CP0544757
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| Compound Name |
US8618299, 15
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| Structure |
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| Formula |
C26H26N4O
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| Molecular Weight |
410.521
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| Canonical SMILES |
Cc1ccc(cn1)-c1ccn(-c2ccc3c4C5CCCN5CCc4n(C)c3c2)c(=O)c1
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| InChI |
InChI=1S/C26H26N4O/c1-17-5-6-19(16-27-17)18-9-13-30(25(31)14-18)20-7-8-21-24(15-20)28(2)22-10-12-29-11-3-4-23(29)26(21)22/h5-9,13-16,23H,3-4,10-12H2,1-2H3
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| InChIKey |
NYQVZBXUKBYNSF-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