General Information of the Compound
| Compound ID |
CP0495426
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| Compound Name |
O-(2-phenoxyethyl) N-phenyl-N-(thiophene-2-carbonyl)carbamothioate
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| Structure |
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| Formula |
C20H17NO3S2
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| Molecular Weight |
383.494
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| Canonical SMILES |
O=C(N(C(=S)OCCOc1ccccc1)c1ccccc1)c1cccs1
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| InChI |
InChI=1S/C20H17NO3S2/c22-19(18-12-7-15-26-18)21(16-8-3-1-4-9-16)20(25)24-14-13-23-17-10-5-2-6-11-17/h1-12,15H,13-14H2
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| InChIKey |
BDBFBFJSXFQEGB-UHFFFAOYSA-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