General Information of the Compound
| Compound ID |
CP0145099
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| Compound Name |
4-[5-(2-chlorophenyl)-1,3-oxazol-4-yl]-9-oxa-3-thia-14-azatricyclo[8.4.0.02,6]tetradeca-1(10),2(6),4,11,13-pentaene
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| Structure |
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| Formula |
C20H13ClN2O2S
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| Molecular Weight |
380.856
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| Canonical SMILES |
Clc1ccccc1-c1ocnc1-c1cc2CCOc3cccnc3-c2s1
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| InChI |
InChI=1S/C20H13ClN2O2S/c21-14-5-2-1-4-13(14)19-18(23-11-25-19)16-10-12-7-9-24-15-6-3-8-22-17(15)20(12)26-16/h1-6,8,10-11H,7,9H2
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| InChIKey |
PIZTWUVVLIIWOV-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