General Information of the Compound
| Compound ID |
CP0175591
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| Compound Name |
8-(1H-benzimidazole-4-carbonyl)-N-[4-(trifluoromethoxy)phenyl]-2,8-diazaspiro[4.5]decane-2-carboxamide
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| Structure |
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| Formula |
C24H24F3N5O3
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| Molecular Weight |
487.482
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| Canonical SMILES |
FC(F)(F)Oc1ccc(NC(=O)N2CCC3(C2)CCN(CC3)C(=O)c2cccc3nc[nH]c23)cc1
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| InChI |
InChI=1S/C24H24F3N5O3/c25-24(26,27)35-17-6-4-16(5-7-17)30-22(34)32-13-10-23(14-32)8-11-31(12-9-23)21(33)18-2-1-3-19-20(18)29-15-28-19/h1-7,15H,8-14H2,(H,28,29)(H,30,34)
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| InChIKey |
DEGVDZROHGNGIT-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