General Information of the Compound
| Compound ID |
CP0387547
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| Compound Name |
(S)-4-(2,5-difluorophenyl)-N-methyl-N-(1-methylpiperidin-4-yl)-2-phenyl-2H-pyrrole-1(5H)-carboxamide
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| Structure |
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| Formula |
C24H27F2N3O
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| Molecular Weight |
411.496
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| Canonical SMILES |
CN(C1CCN(C)CC1)C(=O)N1CC(=C[C@H]1c1ccccc1)c1cc(F)ccc1F
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| InChI |
InChI=1S/C24H27F2N3O/c1-27-12-10-20(11-13-27)28(2)24(30)29-16-18(21-15-19(25)8-9-22(21)26)14-23(29)17-6-4-3-5-7-17/h3-9,14-15,20,23H,10-13,16H2,1-2H3/t23-/m0/s1
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| InChIKey |
ZQSDLUMGBYOLJF-QHCPKHFHSA-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