General Information of the Compound
| Compound ID |
CP0458114
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| Compound Name |
2,3-dichloro-4-[[(1S,2S)-2-pyrrolidin-1-yl-2,3-dihydro-1H-inden-1-yl]oxy]benzenesulfonamide
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| Structure |
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| Formula |
C19H20Cl2N2O3S
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| Molecular Weight |
427.353
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| Canonical SMILES |
NS(=O)(=O)c1ccc(O[C@@H]2[C@H](Cc3ccccc23)N2CCCC2)c(Cl)c1Cl
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| InChI |
InChI=1S/C19H20Cl2N2O3S/c20-17-15(7-8-16(18(17)21)27(22,24)25)26-19-13-6-2-1-5-12(13)11-14(19)23-9-3-4-10-23/h1-2,5-8,14,19H,3-4,9-11H2,(H2,22,24,25)/t14-,19-/m0/s1
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| InChIKey |
WGVDATSCZYCIBM-LIRRHRJNSA-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