General Information of the Compound
| Compound ID |
CP0799674
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| Compound Name |
SID26668753
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| Structure |
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| Formula |
C25H24N4O3
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| Molecular Weight |
428.492
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| Canonical SMILES |
Cn1nc(-c2ccc(N3CCCCC3)c(NC(=O)c3ccco3)c2)c2ccccc2c1=O
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| InChI |
InChI=1S/C25H24N4O3/c1-28-25(31)19-9-4-3-8-18(19)23(27-28)17-11-12-21(29-13-5-2-6-14-29)20(16-17)26-24(30)22-10-7-15-32-22/h3-4,7-12,15-16H,2,5-6,13-14H2,1H3,(H,26,30)
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| InChIKey |
MLCDLCUZTDXWOD-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