General Information of the Compound
| Compound ID |
CP0856505
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| Compound Name |
N,N-dimethyl-3-(2,3,4,5-tetrahydro-1H-benzo[d]azepin-7-yloxy)propan-1-amine
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| Structure |
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| Formula |
C15H24N2O
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| Molecular Weight |
248.37
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| Canonical SMILES |
CN(C)CCCOc1ccc2c(c1)CCNCC2
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| InChI |
InChI=1S/C15H24N2O/c1-17(2)10-3-11-18-15-5-4-13-6-8-16-9-7-14(13)12-15/h4-5,12,16H,3,6-11H2,1-2H3
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| InChIKey |
WJMSULOBJJLPMD-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