General Information of the Compound
| Compound ID |
CP0871295
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| Compound Name |
2-Chloro-4-fluoro-N-(3-(R)-1-pyrrolidin-2-ylmethyl-1H-indol-5-yl)-benzenesulfonamide
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| Structure |
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| Formula |
C19H19ClFN3O2S
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| Molecular Weight |
407.898
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| Canonical SMILES |
O=S(=O)(Nc1ccc2[nH]cc(C[C@H]3CCCN3)c2c1)c1ccc(F)cc1Cl
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| InChI |
InChI=1S/C19H19ClFN3O2S/c20-17-9-13(21)3-6-19(17)27(25,26)24-15-4-5-18-16(10-15)12(11-23-18)8-14-2-1-7-22-14/h3-6,9-11,14,22-24H,1-2,7-8H2/t14-/m1/s1
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| InChIKey |
KDPOEAJPSXPEJK-CQSZACIVSA-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