General Information of the Compound
| Compound ID |
CP0935339
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| Compound Name |
N-(3,3-dimethylbutan-2-yl)-4-(2-fluorobenzoyl)-1H-pyrrole-2-carboxamide
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| Structure |
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| Formula |
C18H21FN2O2
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| Molecular Weight |
316.376
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| Canonical SMILES |
CC(NC(=O)c1cc(C(=O)c2ccccc2F)c[nH]1)C(C)(C)C
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| InChI |
InChI=1S/C18H21FN2O2/c1-11(18(2,3)4)21-17(23)15-9-12(10-20-15)16(22)13-7-5-6-8-14(13)19/h5-11,20H,1-4H3,(H,21,23)
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| InChIKey |
ZPDZHWRUBCTWMA-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