General Information of the Compound
| Compound ID |
CP0160675
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| Compound Name |
2-[(2-{[2-(diethylamino)ethyl]carbamoyl}benzene)sulfonamido]-5,6,7,8-tetrahydronaphthalene-1-carboxylic acid
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| Structure |
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| Formula |
C24H31N3O5S
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| Molecular Weight |
473.595
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| Canonical SMILES |
CCN(CC)CCNC(=O)c1ccccc1S(=O)(=O)Nc1ccc2CCCCc2c1C(O)=O
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| InChI |
InChI=1S/C24H31N3O5S/c1-3-27(4-2)16-15-25-23(28)19-11-7-8-12-21(19)33(31,32)26-20-14-13-17-9-5-6-10-18(17)22(20)24(29)30/h7-8,11-14,26H,3-6,9-10,15-16H2,1-2H3,(H,25,28)(H,29,30)
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| InChIKey |
KRCWUZIIYQCRKQ-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 = 520 nM
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TI
LI
LO
TS
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| 2 |
EC50 = 1200 nM
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TI
LI
LO
TS
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