General Information of the Compound
| Compound ID |
CP0375038
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| Compound Name |
US10047103, 98
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| Structure |
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| Formula |
C24H23N5O6S
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| Molecular Weight |
509.544
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| Canonical SMILES |
COc1nn2cc(nc2s1)-c1cc2c(OCc3coc(n3)N3CC4CCC(C3)O4)cc(OC)cc2o1
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| InChI |
InChI=1S/C24H23N5O6S/c1-30-16-5-19(32-11-13-12-33-22(25-13)28-8-14-3-4-15(9-28)34-14)17-7-21(35-20(17)6-16)18-10-29-23(26-18)36-24(27-29)31-2/h5-7,10,12,14-15H,3-4,8-9,11H2,1-2H3
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| InChIKey |
KBDFMVFWPWXXPE-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