General Information of the Compound
| Compound ID |
CP0488047
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| Compound Name |
1,3-bis(7-{[3-(1H-1,2,3,4-tetrazol-1-yl)phenyl]sulfamoyl}naphthalen-2-yl)urea
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| Structure |
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| Formula |
C35H26N12O5S2
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| Molecular Weight |
758.806
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| Canonical SMILES |
O=C(Nc1ccc2ccc(cc2c1)S(=O)(=O)Nc1cccc(c1)-n1cnnn1)Nc1ccc2ccc(cc2c1)S(=O)(=O)Nc1cccc(c1)-n1cnnn1
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| InChI |
InChI=1S/C35H26N12O5S2/c48-35(38-27-11-7-23-9-13-33(17-25(23)15-27)53(49,50)40-29-3-1-5-31(19-29)46-21-36-42-44-46)39-28-12-8-24-10-14-34(18-26(24)16-28)54(51,52)41-30-4-2-6-32(20-30)47-22-37-43-45-47/h1-22,40-41H,(H2,38,39,48)
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| InChIKey |
MGOKCQQDJREPSG-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