General Information of the Compound
| Compound ID |
CP0502328
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| Compound Name |
1-(4-chlorophenyl)-N-(3,5-difluorophenyl)-2-methyl-2,7-diazaspiro[3.5]nonane-7-carboxamide
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| Structure |
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| Formula |
C21H22ClF2N3O
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| Molecular Weight |
405.876
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| Canonical SMILES |
CN1CC2(CCN(CC2)C(=O)Nc2cc(F)cc(F)c2)C1c1ccc(Cl)cc1
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| InChI |
InChI=1S/C21H22ClF2N3O/c1-26-13-21(19(26)14-2-4-15(22)5-3-14)6-8-27(9-7-21)20(28)25-18-11-16(23)10-17(24)12-18/h2-5,10-12,19H,6-9,13H2,1H3,(H,25,28)
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| InChIKey |
TWBFKHGAPSZHPL-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