General Information of the Compound
| Compound ID |
CP0500596
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| Compound Name |
2,2-dimethyl-N-[3-[4-[4-[(4-methylphenyl)sulfonylamino]butyl]piperazin-1-yl]phenyl]propanamide
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| Structure |
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| Formula |
C26H38N4O3S
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| Molecular Weight |
486.682
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| Canonical SMILES |
Cc1ccc(cc1)S(=O)(=O)NCCCCN1CCN(CC1)c1cccc(NC(=O)C(C)(C)C)c1
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| InChI |
InChI=1S/C26H38N4O3S/c1-21-10-12-24(13-11-21)34(32,33)27-14-5-6-15-29-16-18-30(19-17-29)23-9-7-8-22(20-23)28-25(31)26(2,3)4/h7-13,20,27H,5-6,14-19H2,1-4H3,(H,28,31)
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| InChIKey |
UGLRCQJFRDUWNZ-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