General Information of the Compound
| Compound ID |
CP0374343
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| Compound Name |
2-Benzyl-N-(3-fluorophenyl)-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole-8-sulfonamide
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| Structure |
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| Formula |
C24H22FN3O2S
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| Molecular Weight |
435.524
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| Canonical SMILES |
Fc1cccc(NS(=O)(=O)c2ccc3[nH]c4CCN(Cc5ccccc5)Cc4c3c2)c1
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| InChI |
InChI=1S/C24H22FN3O2S/c25-18-7-4-8-19(13-18)27-31(29,30)20-9-10-23-21(14-20)22-16-28(12-11-24(22)26-23)15-17-5-2-1-3-6-17/h1-10,13-14,26-27H,11-12,15-16H2
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| InChIKey |
KLXAHKWEYNGGPP-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