General Information of the Compound
| Compound ID |
CP0797640
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| Compound Name |
SID17410182
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| Structure |
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| Formula |
C24H18N4O5S2
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| Molecular Weight |
506.565
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| Canonical SMILES |
COc1cccc(N(C(=O)c2ccco2)c2nc(-c3sc(NC(=O)c4ccco4)nc3C)cs2)c1
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| InChI |
InChI=1S/C24H18N4O5S2/c1-14-20(35-23(25-14)27-21(29)18-8-4-10-32-18)17-13-34-24(26-17)28(22(30)19-9-5-11-33-19)15-6-3-7-16(12-15)31-2/h3-13H,1-2H3,(H,25,27,29)
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| InChIKey |
XXFSKUJCODMHKE-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
Protein ID: PT06109, Geminin
Protein ID: PT06124, Paired box protein Pax-8