General Information of the Compound
| Compound ID |
CP0537584
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| Compound Name |
2-[5-(6-fluoro-1H-indol-3-yl)-3-methyl-1,1-dioxo-3H-1,2-benzothiazol-2-yl]ethanesulfonamide
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| Structure |
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| Formula |
C18H18FN3O4S2
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| Molecular Weight |
423.491
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| Canonical SMILES |
CC1N(CCS(N)(=O)=O)S(=O)(=O)c2ccc(cc12)-c1c[nH]c2cc(F)ccc12
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| InChI |
InChI=1S/C18H18FN3O4S2/c1-11-15-8-12(16-10-21-17-9-13(19)3-4-14(16)17)2-5-18(15)28(25,26)22(11)6-7-27(20,23)24/h2-5,8-11,21H,6-7H2,1H3,(H2,20,23,24)
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| InChIKey |
ASNVRAUVNPTTIK-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