General Information of the Compound
| Compound ID |
CP0472145
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| Compound Name |
(S)-N-(8-(4-ethylphenylsulfonamido)-5,6,7,8-tetrahydronaphthalen-2-yl)-3-phenylpropanamide
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| Structure |
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| Formula |
C27H30N2O3S
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| Molecular Weight |
462.615
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| Canonical SMILES |
CCc1ccc(cc1)S(=O)(=O)N[C@H]1CCCc2ccc(NC(=O)CCc3ccccc3)cc12
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| InChI |
InChI=1S/C27H30N2O3S/c1-2-20-11-16-24(17-12-20)33(31,32)29-26-10-6-9-22-14-15-23(19-25(22)26)28-27(30)18-13-21-7-4-3-5-8-21/h3-5,7-8,11-12,14-17,19,26,29H,2,6,9-10,13,18H2,1H3,(H,28,30)/t26-/m0/s1
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| InChIKey |
WUQDLGWMBOEDCD-SANMLTNESA-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