General Information of the Compound
| Compound ID |
CP0512386
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| Compound Name |
3-{[3-chloro-7-(1,3-thiazol-5-yl)quinolin-4-yl]amino}phenol
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| Structure |
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| Formula |
C18H12ClN3OS
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| Molecular Weight |
353.834
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| Canonical SMILES |
Oc1cccc(Nc2c(Cl)cnc3cc(ccc23)-c2cncs2)c1
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| InChI |
InChI=1S/C18H12ClN3OS/c19-15-8-21-16-6-11(17-9-20-10-24-17)4-5-14(16)18(15)22-12-2-1-3-13(23)7-12/h1-10,23H,(H,21,22)
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| InChIKey |
WRJDUUVOTWLITM-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