General Information of the Compound
| Compound ID |
CP0106216
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| Compound Name |
(2S)-1-N-[5-[2-(2-fluorophenyl)-1,3-thiazol-4-yl]-4-methyl-1,3-thiazol-2-yl]pyrrolidine-1,2-dicarboxamide
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| Structure |
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| Formula |
C19H18FN5O2S2
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| Molecular Weight |
431.518
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| Canonical SMILES |
Cc1nc(NC(=O)N2CCC[C@H]2C(N)=O)sc1-c1csc(n1)-c1ccccc1F
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| InChI |
InChI=1S/C19H18FN5O2S2/c1-10-15(13-9-28-17(23-13)11-5-2-3-6-12(11)20)29-18(22-10)24-19(27)25-8-4-7-14(25)16(21)26/h2-3,5-6,9,14H,4,7-8H2,1H3,(H2,21,26)(H,22,24,27)/t14-/m0/s1
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| InChIKey |
XCWDLMRBJQYPBG-AWEZNQCLSA-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