General Information of the Compound
| Compound ID |
CP0437147
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| Compound Name |
CHEMBL1669526
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| Formula |
C17H16ClF3N2O3
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| Molecular Weight |
388.773
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| Canonical SMILES |
O[C@H]1CC[C@@H](CC1)NC(=O)c1noc(c1Cl)-c1ccc(cc1)C(F)(F)F
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| InChI |
InChI=1S/C17H16ClF3N2O3/c18-13-14(16(25)22-11-5-7-12(24)8-6-11)23-26-15(13)9-1-3-10(4-2-9)17(19,20)21/h1-4,11-12,24H,5-8H2,(H,22,25)/t11-,12-
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| InChIKey |
XHNHZYYEGAEZLU-HAQNSBGRSA-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