General Information of the Compound
| Compound ID |
CP0421851
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| Compound Name |
(S)-2-(2-chloropyridin-4-yl)-2-cyclopropyl-N-(5-fluorothiazol-2-yl)acetamide
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| Structure |
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| Formula |
C13H11ClFN3OS
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| Molecular Weight |
311.769
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| Canonical SMILES |
Fc1cnc(NC(=O)[C@@H](C2CC2)c2ccnc(Cl)c2)s1
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| InChI |
InChI=1S/C13H11ClFN3OS/c14-9-5-8(3-4-16-9)11(7-1-2-7)12(19)18-13-17-6-10(15)20-13/h3-7,11H,1-2H2,(H,17,18,19)/t11-/m0/s1
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| InChIKey |
ACAQUQFNLKTVTP-NSHDSACASA-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