General Information of the Compound
| Compound ID |
CP0928456
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| Compound Name |
7-(3-(4,4-difluoropiperidin-1-yl)propoxy)-2,3,4,5-tetrahydro-1H-benzo[d]azepine
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| Structure |
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| Formula |
C18H26F2N2O
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| Molecular Weight |
324.415
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| Canonical SMILES |
FC1(F)CCN(CCCOc2ccc3c(c2)CCNCC3)CC1
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| InChI |
InChI=1S/C18H26F2N2O/c19-18(20)6-11-22(12-7-18)10-1-13-23-17-3-2-15-4-8-21-9-5-16(15)14-17/h2-3,14,21H,1,4-13H2
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| InChIKey |
FWDVKDASAFTDAN-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