General Information of the Compound
| Compound ID |
CP0473370
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| Compound Name |
(2S)-3-(4-chlorophenyl)-N-[2-(dimethylamino)ethyl]-2-[(4-methoxy-2,3,6-trimethylphenyl)sulfonylamino]propanamide
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| Structure |
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| Formula |
C23H32ClN3O4S
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| Molecular Weight |
482.046
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| Canonical SMILES |
COc1cc(C)c(c(C)c1C)S(=O)(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)NCCN(C)C
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| InChI |
InChI=1S/C23H32ClN3O4S/c1-15-13-21(31-6)16(2)17(3)22(15)32(29,30)26-20(23(28)25-11-12-27(4)5)14-18-7-9-19(24)10-8-18/h7-10,13,20,26H,11-12,14H2,1-6H3,(H,25,28)/t20-/m0/s1
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| InChIKey |
FEOPGIYQCTWVPH-FQEVSTJZSA-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