General Information of the Compound
| Compound ID |
CP0415480
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| Compound Name |
N-(1-benzylpiperidin-4-yl)-8-chloro-6H-pyrido[2,3-b][1,5]benzoxazepin-5-imine
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| Structure |
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| Formula |
C24H23ClN4O
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| Molecular Weight |
418.928
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| Canonical SMILES |
Clc1ccc2Oc3ncccc3C(NC3CCN(Cc4ccccc4)CC3)=Nc2c1
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| InChI |
InChI=1S/C24H23ClN4O/c25-18-8-9-22-21(15-18)28-23(20-7-4-12-26-24(20)30-22)27-19-10-13-29(14-11-19)16-17-5-2-1-3-6-17/h1-9,12,15,19H,10-11,13-14,16H2,(H,27,28)
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| InChIKey |
JIXGNLVXUHTAKO-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