General Information of the Compound
| Compound ID |
CP0411090
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| Compound Name |
3-(3-chlorophenylsulfonyl)-1-(pyrrolidin-3-yl)-1H-indole
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| Structure |
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| Formula |
C18H17ClN2O2S
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| Molecular Weight |
360.866
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| Canonical SMILES |
Clc1cccc(c1)S(=O)(=O)c1cn(C2CCNC2)c2ccccc12
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| InChI |
InChI=1S/C18H17ClN2O2S/c19-13-4-3-5-15(10-13)24(22,23)18-12-21(14-8-9-20-11-14)17-7-2-1-6-16(17)18/h1-7,10,12,14,20H,8-9,11H2
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| InChIKey |
IYJZDLOAWKCXJN-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