General Information of the Compound
| Compound ID |
CP0479451
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| Compound Name |
8-(4-chloro-6-methoxy-1,3-benzothiazol-2-yl)-6-ethyl-3-methylquinazolin-4-one
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| Formula |
C19H16ClN3O2S
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| Molecular Weight |
385.876
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| Canonical SMILES |
CCc1cc(-c2nc3c(Cl)cc(OC)cc3s2)c2ncn(C)c(=O)c2c1
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| InChI |
InChI=1S/C19H16ClN3O2S/c1-4-10-5-12(16-13(6-10)19(24)23(2)9-21-16)18-22-17-14(20)7-11(25-3)8-15(17)26-18/h5-9H,4H2,1-3H3
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| InChIKey |
DUWRZIFULVNPGV-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
Protein ID: PT01871, Proteinase-activated receptor 1
Protein ID: PT04124, Proteinase-activated receptor 2
Protein ID: PT04808, Proteinase-activated receptor 4