General Information of the Compound
| Compound ID |
CP0113656
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| Compound Name |
N-[(2S)-1-[[1-(6-fluoropyridin-3-yl)indazol-4-yl]amino]propan-2-yl]-2,4,6-trimethylbenzenesulfonamide
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| Structure |
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| Formula |
C24H26FN5O2S
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| Molecular Weight |
467.57
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| Canonical SMILES |
C[C@@H](CNc1cccc2n(ncc12)-c1ccc(F)nc1)NS(=O)(=O)c1c(C)cc(C)cc1C
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| InChI |
InChI=1S/C24H26FN5O2S/c1-15-10-16(2)24(17(3)11-15)33(31,32)29-18(4)12-26-21-6-5-7-22-20(21)14-28-30(22)19-8-9-23(25)27-13-19/h5-11,13-14,18,26,29H,12H2,1-4H3/t18-/m0/s1
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| InChIKey |
LPHVQLUOXSQBIZ-SFHVURJKSA-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