General Information of the Compound
| Compound ID |
CP0157631
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| Compound Name |
4-butyl-N-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)benzenesulfonamide
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| Structure |
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| Formula |
C20H26N2O2S
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| Molecular Weight |
358.507
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| Canonical SMILES |
CCCCc1ccc(cc1)S(=O)(=O)Nc1ccc2CCNCCc2c1
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| InChI |
InChI=1S/C20H26N2O2S/c1-2-3-4-16-5-9-20(10-6-16)25(23,24)22-19-8-7-17-11-13-21-14-12-18(17)15-19/h5-10,15,21-22H,2-4,11-14H2,1H3
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| InChIKey |
DFONPZSBELPUSI-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
Protein ID: PT01005, D(2) dopamine receptor
Protein ID: PT00943, D(3) dopamine receptor
Protein ID: PT01121, Motilin receptor