General Information of the Compound
| Compound ID |
CP0554158
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| Compound Name |
CHEMBL5072209
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| Formula |
C19H20F2N2O3
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| Molecular Weight |
362.376
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| Canonical SMILES |
FC1(F)C2CN(CCC12c1ccccc1)C(=O)[C@H]1C[C@@]2(C1)COC(=O)N2
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| InChI |
InChI=1S/C19H20F2N2O3/c20-19(21)14-10-23(7-6-18(14,19)13-4-2-1-3-5-13)15(24)12-8-17(9-12)11-26-16(25)22-17/h1-5,12,14H,6-11H2,(H,22,25)/t12-,14?,17+,18?
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| InChIKey |
CZNDCKHIMYPXHJ-MTRHIFGBSA-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