General Information of the Compound
| Compound ID |
CP0514319
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| Compound Name |
(S)-2-(4-chlorophenyl)-N-(thiazol-2-yl)pent-4-enamide
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| Structure |
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| Formula |
C14H13ClN2OS
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| Molecular Weight |
292.791
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| Canonical SMILES |
Clc1ccc(cc1)[C@H](CC=C)C(=O)Nc1nccs1
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| InChI |
InChI=1S/C14H13ClN2OS/c1-2-3-12(10-4-6-11(15)7-5-10)13(18)17-14-16-8-9-19-14/h2,4-9,12H,1,3H2,(H,16,17,18)/t12-/m0/s1
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| InChIKey |
HSOAIKDJQLYYGH-LBPRGKRZSA-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