General Information of the Compound
| Compound ID |
CP0544142
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| Compound Name |
N-[(1S,2S)-2-(3,4-dihydro-1H-isoquinolin-2-yl)cyclohexyl]benzenesulfonamide
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| Formula |
C21H26N2O2S
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| Molecular Weight |
370.518
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| Canonical SMILES |
O=S(=O)(N[C@H]1CCCC[C@@H]1N1CCc2ccccc2C1)c1ccccc1
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| InChI |
InChI=1S/C21H26N2O2S/c24-26(25,19-10-2-1-3-11-19)22-20-12-6-7-13-21(20)23-15-14-17-8-4-5-9-18(17)16-23/h1-5,8-11,20-22H,6-7,12-16H2/t20-,21-/m0/s1
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| InChIKey |
UHOANONOOFZNKU-SFTDATJTSA-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: PT05965, Mucolipin-1
Protein ID: PT07510, Mucolipin-2
Protein ID: PT06343, Mucolipin-3