General Information of the Compound
| Compound ID |
CP0915293
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| Compound Name |
SID85811561
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| Structure |
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| Formula |
C32H37F3N4O6S
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| Molecular Weight |
662.731
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| Canonical SMILES |
Cc1ccc(S(=O)(=O)Nc2ccc3c(c2)CC(=O)N([C@@H](C)CO)C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(C(F)(F)F)cc2)O3)cc1
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| InChI |
InChI=1S/C32H37F3N4O6S/c1-20-5-12-27(13-6-20)46(43,44)37-26-11-14-28-23(15-26)16-30(41)39(22(3)19-40)17-21(2)29(45-28)18-38(4)31(42)36-25-9-7-24(8-10-25)32(33,34)35/h5-15,21-22,29,37,40H,16-19H2,1-4H3,(H,36,42)/t21-,22-,29+/m0/s1
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| InChIKey |
BDNZOJPJXUEPBB-IHMCZWCLSA-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