General Information of the Compound
| Compound ID |
CP0900882
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| Compound Name |
N'1-(6-Ethyl-2-pyridin-4-yl-thieno[2,3-d]pyrimidin-4-yl)-ethane-1,2-diamine
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| Structure |
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| Formula |
C15H17N5S
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| Molecular Weight |
299.403
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| Canonical SMILES |
CCc1cc2c(NCCN)nc(-c3ccncc3)nc2s1
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| InChI |
InChI=1S/C15H17N5S/c1-2-11-9-12-14(18-8-5-16)19-13(20-15(12)21-11)10-3-6-17-7-4-10/h3-4,6-7,9H,2,5,8,16H2,1H3,(H,18,19,20)
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| InChIKey |
KKVDCWSPGZUUKI-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