General Information of the Compound
| Compound ID |
CP0539240
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| Compound Name |
N-[4-(7-fluoro-2,3,4,5-tetrahydro-1-benzazepin-1-yl)-2,6-dimethylphenyl]-3,3-dimethylbutanamide
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| Structure |
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| Formula |
C24H31FN2O
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| Molecular Weight |
382.523
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| Canonical SMILES |
Cc1cc(cc(C)c1NC(=O)CC(C)(C)C)N1CCCCc2cc(F)ccc12
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| InChI |
InChI=1S/C24H31FN2O/c1-16-12-20(13-17(2)23(16)26-22(28)15-24(3,4)5)27-11-7-6-8-18-14-19(25)9-10-21(18)27/h9-10,12-14H,6-8,11,15H2,1-5H3,(H,26,28)
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| InChIKey |
UJGBDZGXZUIEKZ-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