General Information of the Compound
| Compound ID |
CP0215409
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| Compound Name |
2-[(2-{[2-(diethylamino)ethane]sulfinyl}-4-fluorobenzene)sulfonamido]-5,6,7,8-tetrahydronaphthalene-1-carboxylic acid
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| Structure |
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| Formula |
C23H29FN2O5S2
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| Molecular Weight |
496.626
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| Canonical SMILES |
CCN(CC)CCS(=O)c1cc(F)ccc1S(=O)(=O)Nc1ccc2CCCCc2c1C(O)=O
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| InChI |
InChI=1S/C23H29FN2O5S2/c1-3-26(4-2)13-14-32(29)20-15-17(24)10-12-21(20)33(30,31)25-19-11-9-16-7-5-6-8-18(16)22(19)23(27)28/h9-12,15,25H,3-8,13-14H2,1-2H3,(H,27,28)
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| InChIKey |
IKZNWNKZLIJMJT-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
Protein ID: PT00973, Methionine aminopeptidase 2
Cell Viability or Cytotoxicity Assay
| Cell Line ID | Cell Line Name | Cell Line Organism | |
| CL000156 | HT-1080 | Homo sapiens (Human) | 2 |
| 1 |
EC50 = 110 nM
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TI
LI
LO
TS
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| 2 |
EC50 = 600 nM
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TI
LI
LO
TS
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