General Information of the Compound
| Compound ID |
CP0497843
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| Compound Name |
5-[6-(4-Fluoro-benzenesulfonylamino)-1,2,3,4-tetrahydro-carbazol-9-yl]-pentanoic acid
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| Structure |
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| Formula |
C23H25FN2O4S
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| Molecular Weight |
444.528
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| Canonical SMILES |
OC(=O)CCCCn1c2CCCCc2c2cc(NS(=O)(=O)c3ccc(F)cc3)ccc12
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| InChI |
InChI=1S/C23H25FN2O4S/c24-16-8-11-18(12-9-16)31(29,30)25-17-10-13-22-20(15-17)19-5-1-2-6-21(19)26(22)14-4-3-7-23(27)28/h8-13,15,25H,1-7,14H2,(H,27,28)
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| InChIKey |
ALQISIGUVXFHCF-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