General Information of the Compound
| Compound ID |
CP0507901
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| Compound Name |
3-(morpholin-4-ylmethyl)-5-quinolin-2-yl-1,3,4-oxadiazole-2-thione
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| Structure |
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| Formula |
C16H16N4O2S
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| Molecular Weight |
328.397
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| Canonical SMILES |
S=c1oc(nn1CN1CCOCC1)-c1ccc2ccccc2n1
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| InChI |
InChI=1S/C16H16N4O2S/c23-16-20(11-19-7-9-21-10-8-19)18-15(22-16)14-6-5-12-3-1-2-4-13(12)17-14/h1-6H,7-11H2
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| InChIKey |
CYCHZAXJCFZDRM-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