General Information of the Compound
| Compound ID |
CP0567270
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| Compound Name |
12-chloro-4-ethylsulfonyl-23-methyl-8,19-dioxa-6,23-diazatetracyclo[18.4.0.02,7.09,14]tetracosa-1(24),2(7),3,5,9(14),10,12,20-octaen-22-one
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| Structure |
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| Formula |
C23H23ClN2O5S
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| Molecular Weight |
474.966
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| Canonical SMILES |
CCS(=O)(=O)c1cnc2Oc3ccc(Cl)cc3CCCCOc3cc(=O)n(C)cc3-c2c1
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| InChI |
InChI=1S/C23H23ClN2O5S/c1-3-32(28,29)17-11-18-19-14-26(2)22(27)12-21(19)30-9-5-4-6-15-10-16(24)7-8-20(15)31-23(18)25-13-17/h7-8,10-14H,3-6,9H2,1-2H3
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| InChIKey |
DWSPVJWMVBWDOF-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