General Information of the Compound
| Compound ID |
CP0415479
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| Compound Name |
8-chloro-N-(2-morpholin-4-ylethyl)-6H-pyrido[2,3-b][1,5]benzoxazepin-5-imine
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| Structure |
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| Formula |
C18H19ClN4O2
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| Molecular Weight |
358.829
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| Canonical SMILES |
Clc1ccc2Oc3ncccc3C(NCCN3CCOCC3)=Nc2c1
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| InChI |
InChI=1S/C18H19ClN4O2/c19-13-3-4-16-15(12-13)22-17(14-2-1-5-21-18(14)25-16)20-6-7-23-8-10-24-11-9-23/h1-5,12H,6-11H2,(H,20,22)
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| InChIKey |
VXQVWOMDFJJBFB-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