General Information of the Compound
| Compound ID |
CP0908462
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| Compound Name |
CO-ADD:0135932
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| Structure |
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| Formula |
C14H10N2S
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| Molecular Weight |
238.315
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| Canonical SMILES |
c1ccc(Sc2ncnc3ccccc23)cc1
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| InChI |
InChI=1S/C14H10N2S/c1-2-6-11(7-3-1)17-14-12-8-4-5-9-13(12)15-10-16-14/h1-10H
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| InChIKey |
BBMSQSLFLZTVRX-UHFFFAOYSA-N
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| CAS |
6344-76-9
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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