General Information of the Compound
| Compound ID |
CP0525637
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| Compound Name |
5-[6-amino-5-[(2,6-dichloro-3-fluorophenyl)methoxy]pyridin-3-yl]-1'-methylspiro[1H-indole-3,4'-piperidine]-2-one
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| Structure |
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| Formula |
C25H23Cl2FN4O2
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| Molecular Weight |
501.389
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| Canonical SMILES |
CN1CCC2(CC1)C(=O)Nc1ccc(cc21)-c1cnc(N)c(OCc2c(Cl)ccc(F)c2Cl)c1
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| InChI |
InChI=1S/C25H23Cl2FN4O2/c1-32-8-6-25(7-9-32)17-10-14(2-5-20(17)31-24(25)33)15-11-21(23(29)30-12-15)34-13-16-18(26)3-4-19(28)22(16)27/h2-5,10-12H,6-9,13H2,1H3,(H2,29,30)(H,31,33)
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| InChIKey |
BHAPGOUPQLWNMP-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