General Information of the Compound
| Compound ID |
CP0421965
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| Compound Name |
1-(4-chlorophenyl)-2-(3-fluorophenyl)-N-((S)-1-(4-fluorophenyl)ethyl)-3-oxo-2,7-diazaspiro[3.5]nonane-7-carboxamide
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| Structure |
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| Formula |
C28H26ClF2N3O2
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| Molecular Weight |
509.984
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| Canonical SMILES |
C[C@H](NC(=O)N1CCC2(CC1)C(N(C2=O)c1cccc(F)c1)c1ccc(Cl)cc1)c1ccc(F)cc1
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| InChI |
InChI=1S/C28H26ClF2N3O2/c1-18(19-7-11-22(30)12-8-19)32-27(36)33-15-13-28(14-16-33)25(20-5-9-21(29)10-6-20)34(26(28)35)24-4-2-3-23(31)17-24/h2-12,17-18,25H,13-16H2,1H3,(H,32,36)/t18-,25?/m0/s1
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| InChIKey |
KIWXEKYVQCAGCH-CPFIQGLUSA-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