General Information of the Compound
| Compound ID |
CP0306040
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| Compound Name |
2-[(2-{[5-(diethylamino)pentan-2-yl]amino}benzene)sulfonamido]-5,6,7,8-tetrahydronaphthalene-1-carboxylic acid
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| Structure |
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| Formula |
C26H37N3O4S
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| Molecular Weight |
487.666
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| Canonical SMILES |
CCN(CC)CCCC(C)Nc1ccccc1S(=O)(=O)Nc1ccc2CCCCc2c1C(O)=O
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| InChI |
InChI=1S/C26H37N3O4S/c1-4-29(5-2)18-10-11-19(3)27-22-14-8-9-15-24(22)34(32,33)28-23-17-16-20-12-6-7-13-21(20)25(23)26(30)31/h8-9,14-17,19,27-28H,4-7,10-13,18H2,1-3H3,(H,30,31)
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| InChIKey |
AFNZSEVDWZQGKS-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