General Information of the Compound
| Compound ID |
CP0904473
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| Compound Name |
N'1-(6-Phenyl-2-pyridin-4-yl-thieno[3,2-d]pyrimidin-4-yl)-ethane-1,2-diamine
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| Structure |
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| Formula |
C19H17N5S
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| Molecular Weight |
347.447
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| Canonical SMILES |
NCCNc1nc(-c2ccncc2)nc2cc(-c3ccccc3)sc12
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| InChI |
InChI=1S/C19H17N5S/c20-8-11-22-19-17-15(12-16(25-17)13-4-2-1-3-5-13)23-18(24-19)14-6-9-21-10-7-14/h1-7,9-10,12H,8,11,20H2,(H,22,23,24)
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| InChIKey |
XQXKRZOOAYZRRH-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