General Information of the Compound
| Compound ID |
CP0395531
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| Compound Name |
2-Amino-N-{4-[5-amino-1-(4-trifluoromethyl-phenyl)-1H-pyrazol-3-yl]-cyclohexylmethyl}-benzenesulfonamide
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| Structure |
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| Formula |
C23H26F3N5O2S
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| Molecular Weight |
493.555
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| Canonical SMILES |
Nc1cc(nn1-c1ccc(cc1)C(F)(F)F)C1CCC(CNS(=O)(=O)c2ccccc2N)CC1
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| InChI |
InChI=1S/C23H26F3N5O2S/c24-23(25,26)17-9-11-18(12-10-17)31-22(28)13-20(30-31)16-7-5-15(6-8-16)14-29-34(32,33)21-4-2-1-3-19(21)27/h1-4,9-13,15-16,29H,5-8,14,27-28H2
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| InChIKey |
PIMGSWUKUUYMBZ-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