General Information of the Compound
| Compound ID |
CP0890217
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| Compound Name |
SID22403644
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| Structure |
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| Formula |
C26H21NO3S2
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| Molecular Weight |
459.592
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| Canonical SMILES |
O=C(COC(=O)/C(=C/c1cccs1)c1cccs1)NC(c1ccccc1)c1ccccc1
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| InChI |
InChI=1S/C26H21NO3S2/c28-24(27-25(19-9-3-1-4-10-19)20-11-5-2-6-12-20)18-30-26(29)22(23-14-8-16-32-23)17-21-13-7-15-31-21/h1-17,25H,18H2,(H,27,28)/b22-17+
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| InChIKey |
SGBGAVVZRGNMFF-OQKWZONESA-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