General Information of the Compound
| Compound ID |
CP0231660
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| Compound Name |
N-[[4-(benzylsulfamoyl)phenyl]carbamothioyl]-4-phenylbenzamide
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| Structure |
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| Formula |
C27H23N3O3S2
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| Molecular Weight |
501.633
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| Canonical SMILES |
O=C(NC(=S)Nc1ccc(cc1)S(=O)(=O)NCc1ccccc1)c1ccc(cc1)-c1ccccc1
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| InChI |
InChI=1S/C27H23N3O3S2/c31-26(23-13-11-22(12-14-23)21-9-5-2-6-10-21)30-27(34)29-24-15-17-25(18-16-24)35(32,33)28-19-20-7-3-1-4-8-20/h1-18,28H,19H2,(H2,29,30,31,34)
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| InChIKey |
QQYMUURPGPFRCN-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