General Information of the Compound
| Compound ID |
CP0874413
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| Compound Name |
1-[4-Amino-9-(tert-butyl-dimethyl-silanyloxy)-6-(tert-butyl-dimethyl-silanyloxymethyl)-2,2-dioxo-3-vinyl-1,7-dioxa-2lambda*6*-thia-spiro[4.4]non-3-en-8-yl]-5-methyl-1H-pyrimidine-2,4-dione
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| Structure |
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| Formula |
C26H45N3O8SSi2
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| Molecular Weight |
615.898
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| Canonical SMILES |
C=CC1=C(N)[C@@]2(OS1(=O)=O)[C@@H](CO[Si](C)(C)C(C)(C)C)O[C@@H](n1cc(C)c(=O)[nH]c1=O)[C@@H]2O[Si](C)(C)C(C)(C)C
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| InChI |
InChI=1S/C26H45N3O8SSi2/c1-13-17-19(27)26(37-38(17,32)33)18(15-34-39(9,10)24(3,4)5)35-22(20(26)36-40(11,12)25(6,7)8)29-14-16(2)21(30)28-23(29)31/h13-14,18,20,22H,1,15,27H2,2-12H3,(H,28,30,31)/t18-,20+,22-,26+/m1/s1
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| InChIKey |
SNMFKAHHODTTJY-VCDUZZEYSA-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