General Information of the Compound
| Compound ID |
CP0525573
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| Compound Name |
N-methyl-N-[(1R,3S)-3-[(5-methyl-3-propan-2-ylimidazol-4-yl)carbamoyl]cyclohexyl]-3-(trifluoromethyl)benzamide
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| Structure |
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| Formula |
C23H29F3N4O2
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| Molecular Weight |
450.505
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| Canonical SMILES |
CC(C)n1cnc(C)c1NC(=O)[C@H]1CCC[C@H](C1)N(C)C(=O)c1cccc(c1)C(F)(F)F
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| InChI |
InChI=1S/C23H29F3N4O2/c1-14(2)30-13-27-15(3)20(30)28-21(31)16-7-6-10-19(12-16)29(4)22(32)17-8-5-9-18(11-17)23(24,25)26/h5,8-9,11,13-14,16,19H,6-7,10,12H2,1-4H3,(H,28,31)/t16-,19+/m0/s1
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| InChIKey |
MUCZOYWGYAOSGV-QFBILLFUSA-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