General Information of the Compound
| Compound ID |
CP0857928
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| Compound Name |
SID16953265
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| Structure |
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| Formula |
C23H27ClN4O2
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| Molecular Weight |
426.948
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| Canonical SMILES |
Cc1ccc2nc(O)c(CN(CCCN(C)C)C(=O)Nc3cccc(Cl)c3)cc2c1
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| InChI |
InChI=1S/C23H27ClN4O2/c1-16-8-9-21-17(12-16)13-18(22(29)26-21)15-28(11-5-10-27(2)3)23(30)25-20-7-4-6-19(24)14-20/h4,6-9,12-14H,5,10-11,15H2,1-3H3,(H,25,30)(H,26,29)
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| InChIKey |
GBGNDDHCIPNWDB-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