General Information of the Compound
| Compound ID |
CP0568247
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| Compound Name |
US9409917, 106
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| Structure |
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| Formula |
C17H16Cl2N2O2
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| Molecular Weight |
351.233
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| Canonical SMILES |
Clc1ccc(CCCNC(=O)C2COc3ncccc23)c(Cl)c1
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| InChI |
InChI=1S/C17H16Cl2N2O2/c18-12-6-5-11(15(19)9-12)3-1-7-20-16(22)14-10-23-17-13(14)4-2-8-21-17/h2,4-6,8-9,14H,1,3,7,10H2,(H,20,22)
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| InChIKey |
ICVYFJUGDDMKTI-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