General Information of the Compound
| Compound ID |
CP0519923
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| Compound Name |
US9303045, 174
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| Structure |
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| Formula |
C23H25N3O2
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| Molecular Weight |
375.472
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| Canonical SMILES |
CN1C2COCC1CC(C2)NC(=O)c1cn(-c2ccccc2)c2ccccc12
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| InChI |
InChI=1S/C23H25N3O2/c1-25-18-11-16(12-19(25)15-28-14-18)24-23(27)21-13-26(17-7-3-2-4-8-17)22-10-6-5-9-20(21)22/h2-10,13,16,18-19H,11-12,14-15H2,1H3,(H,24,27)
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| InChIKey |
JVZYMLLIFUSHQB-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