General Information of the Compound
| Compound ID |
CP0405324
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| Compound Name |
5-[6-chloro-2-(2,6-diazaspiro[3.3]heptan-2-yl)-1-[(4-fluorophenyl)methyl]benzimidazol-4-yl]-4-methylpyrimidin-2-amine
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| Structure |
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| Formula |
C24H23ClFN7
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| Molecular Weight |
463.948
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| Canonical SMILES |
Cc1nc(N)ncc1-c1cc(Cl)cc2n(Cc3ccc(F)cc3)c(nc12)N1CC2(CNC2)C1
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| InChI |
InChI=1S/C24H23ClFN7/c1-14-19(8-29-22(27)30-14)18-6-16(25)7-20-21(18)31-23(32-12-24(13-32)10-28-11-24)33(20)9-15-2-4-17(26)5-3-15/h2-8,28H,9-13H2,1H3,(H2,27,29,30)
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| InChIKey |
ANXNBGIHYWKLAR-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