General Information of the Compound
| Compound ID |
CP0202384
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| Compound Name |
4-methyl-N-[4-[4-(4-nitrophenyl)piperazine-1-carbonyl]benzyl]benzenesulfonamide
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| Structure |
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| Formula |
C25H26N4O5S
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| Molecular Weight |
494.573
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| Canonical SMILES |
Cc1ccc(cc1)S(=O)(=O)NCc1ccc(cc1)C(=O)N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O
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| InChI |
InChI=1S/C25H26N4O5S/c1-19-2-12-24(13-3-19)35(33,34)26-18-20-4-6-21(7-5-20)25(30)28-16-14-27(15-17-28)22-8-10-23(11-9-22)29(31)32/h2-13,26H,14-18H2,1H3
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| InChIKey |
NEUBBJUUDXCEOX-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