General Information of the Compound
| Compound ID |
CP0486712
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| Compound Name |
N-[5-[[8-[(2,6-dimethylpyridin-4-yl)methyl]-2-azaspiro[4.4]nonan-2-yl]methyl]-1,3-thiazol-2-yl]acetamide
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| Formula |
C22H30N4OS
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| Molecular Weight |
398.576
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| Canonical SMILES |
CC(=O)Nc1ncc(CN2CCC3(CCC(Cc4cc(C)nc(C)c4)C3)C2)s1
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| InChI |
InChI=1S/C22H30N4OS/c1-15-8-19(9-16(2)24-15)10-18-4-5-22(11-18)6-7-26(14-22)13-20-12-23-21(28-20)25-17(3)27/h8-9,12,18H,4-7,10-11,13-14H2,1-3H3,(H,23,25,27)
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| InChIKey |
ZKVUTIROLMNHNB-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