General Information of the Compound
| Compound ID |
CP0282556
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| Compound Name |
bicyclic sulfonamide analogue, 14
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| Structure |
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| Formula |
C28H40N4O5S
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| Molecular Weight |
544.718
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| Canonical SMILES |
CCNc1cc(cc2N(C)S(=O)(=O)CCCc12)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1CCOCC1
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| InChI |
InChI=1S/C28H40N4O5S/c1-3-29-24-17-21(18-26-23(24)10-7-15-38(35,36)32(26)2)28(34)31-25(16-20-8-5-4-6-9-20)27(33)19-30-22-11-13-37-14-12-22/h4-6,8-9,17-18,22,25,27,29-30,33H,3,7,10-16,19H2,1-2H3,(H,31,34)/t25-,27+/m0/s1
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| InChIKey |
KTXBXDPQEZZPTQ-AHKZPQOWSA-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