General Information of the Compound
| Compound ID |
CP0166092
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| Compound Name |
3-[4-[5-(methoxymethyl)-1,2,4-oxadiazol-3-yl]phenyl]-8-[(3-methylpyridin-2-yl)methyl]-1-(6-oxo-1H-pyrimidin-4-yl)-1,3,8-triazaspiro[4.5]decane-2,4-dione
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| Structure |
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| Formula |
C28H28N8O5
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| Molecular Weight |
556.583
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| Canonical SMILES |
COCc1nc(no1)-c1ccc(cc1)N1C(=O)N(c2cc(=O)[nH]cn2)C2(CCN(Cc3ncccc3C)CC2)C1=O
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| InChI |
InChI=1S/C28H28N8O5/c1-18-4-3-11-29-21(18)15-34-12-9-28(10-13-34)26(38)35(27(39)36(28)22-14-23(37)31-17-30-22)20-7-5-19(6-8-20)25-32-24(16-40-2)41-33-25/h3-8,11,14,17H,9-10,12-13,15-16H2,1-2H3,(H,30,31,37)
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| InChIKey |
SPCSFCKHCIOCTM-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