General Information of the Compound
| Compound ID |
CP0411089
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| Compound Name |
6-chloro-3-(3-fluorophenylsulfonyl)-1-(pyrrolidin-3-yl)-1H-indole
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| Structure |
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| Formula |
C18H16ClFN2O2S
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| Molecular Weight |
378.856
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| Canonical SMILES |
Fc1cccc(c1)S(=O)(=O)c1cn(C2CCNC2)c2cc(Cl)ccc12
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| InChI |
InChI=1S/C18H16ClFN2O2S/c19-12-4-5-16-17(8-12)22(14-6-7-21-10-14)11-18(16)25(23,24)15-3-1-2-13(20)9-15/h1-5,8-9,11,14,21H,6-7,10H2
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| InChIKey |
AFTKXLGGILZMHW-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