General Information of the Compound
| Compound ID |
CP0466044
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| Compound Name |
(2-phenyl-5-propyl-1,3-thiazol-4-yl) propyl carbonate
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| Structure |
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| Formula |
C16H19NO3S
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| Molecular Weight |
305.399
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| Canonical SMILES |
CCCOC(=O)Oc1nc(sc1CCC)-c1ccccc1
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| InChI |
InChI=1S/C16H19NO3S/c1-3-8-13-14(20-16(18)19-11-4-2)17-15(21-13)12-9-6-5-7-10-12/h5-7,9-10H,3-4,8,11H2,1-2H3
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| InChIKey |
HLDFRGGMHXZOIZ-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