General Information of the Compound
| Compound ID |
CP0241917
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| Compound Name |
1-(3-chloro-4-methoxyphenyl)-3-(2-morpholin-4-ylethyl)thiourea
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| Structure |
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| Formula |
C14H20ClN3O2S
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| Molecular Weight |
329.853
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| Canonical SMILES |
COc1ccc(NC(=S)NCCN2CCOCC2)cc1Cl
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| InChI |
InChI=1S/C14H20ClN3O2S/c1-19-13-3-2-11(10-12(13)15)17-14(21)16-4-5-18-6-8-20-9-7-18/h2-3,10H,4-9H2,1H3,(H2,16,17,21)
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| InChIKey |
GIWMAITYUJGWGK-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