General Information of the Compound
| Compound ID |
CP0461204
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| Compound Name |
N-[(5-fluoro-8-hydroxyquinolin-7-yl)-thiophen-2-ylmethyl]acetamide
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| Structure |
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| Formula |
C16H13FN2O2S
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| Molecular Weight |
316.357
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| Canonical SMILES |
CC(=O)NC(c1cccs1)c1cc(F)c2cccnc2c1O
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| InChI |
InChI=1S/C16H13FN2O2S/c1-9(20)19-14(13-5-3-7-22-13)11-8-12(17)10-4-2-6-18-15(10)16(11)21/h2-8,14,21H,1H3,(H,19,20)
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| InChIKey |
VNAWUBPFFPSYKR-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: PT06109, Geminin
Protein ID: PT06101, Latent membrane protein 1