General Information of the Compound
| Compound ID |
CP0819095
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| Compound Name |
SID17387625
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| Structure |
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| Formula |
C26H26ClN3O2S
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| Molecular Weight |
480.033
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| Canonical SMILES |
Cc1ccccc1C(=O)N1CCN(c2ccc(NC(=O)CSc3ccc(Cl)cc3)cc2)CC1
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| InChI |
InChI=1S/C26H26ClN3O2S/c1-19-4-2-3-5-24(19)26(32)30-16-14-29(15-17-30)22-10-8-21(9-11-22)28-25(31)18-33-23-12-6-20(27)7-13-23/h2-13H,14-18H2,1H3,(H,28,31)
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| InChIKey |
HWLGXOFSMYQGBA-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