General Information of the Compound
| Compound ID |
CP0568345
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| Compound Name |
(2S)-N-(4-fluorophenyl)-2-(4-phenyl-1,3-thiazol-2-yl)pyrrolidine-1-carboxamide
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| Structure |
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| Formula |
C20H18FN3OS
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| Molecular Weight |
367.449
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| Canonical SMILES |
Fc1ccc(NC(=O)N2CCC[C@H]2c2nc(cs2)-c2ccccc2)cc1
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| InChI |
InChI=1S/C20H18FN3OS/c21-15-8-10-16(11-9-15)22-20(25)24-12-4-7-18(24)19-23-17(13-26-19)14-5-2-1-3-6-14/h1-3,5-6,8-11,13,18H,4,7,12H2,(H,22,25)/t18-/m0/s1
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| InChIKey |
BMTLWMDBGAZZNL-SFHVURJKSA-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