General Information of the Compound
| Compound ID |
CP0401502
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| Compound Name |
(S)-4-((N-benzyl-4-chlorophenylsulfonamido)methyl)-N-((tetrahydrofuran-2-yl)methyl)benzamide
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| Structure |
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| Formula |
C26H27ClN2O4S
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| Molecular Weight |
499.032
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| Canonical SMILES |
Clc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)Cc1ccc(cc1)C(=O)NC[C@@H]1CCCO1
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| InChI |
InChI=1S/C26H27ClN2O4S/c27-23-12-14-25(15-13-23)34(31,32)29(18-20-5-2-1-3-6-20)19-21-8-10-22(11-9-21)26(30)28-17-24-7-4-16-33-24/h1-3,5-6,8-15,24H,4,7,16-19H2,(H,28,30)/t24-/m0/s1
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| InChIKey |
MWDZLAFEMAKFCK-DEOSSOPVSA-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