General Information of the Compound
| Compound ID |
CP0951933
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| Compound Name |
N'1-(6-Isopropyl-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 |
C16H19N5S
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| Molecular Weight |
313.43
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| Canonical SMILES |
CC(C)c1cc2c(NCCN)nc(-c3ccncc3)nc2s1
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| InChI |
InChI=1S/C16H19N5S/c1-10(2)13-9-12-15(19-8-5-17)20-14(21-16(12)22-13)11-3-6-18-7-4-11/h3-4,6-7,9-10H,5,8,17H2,1-2H3,(H,19,20,21)
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| InChIKey |
PJQXMTRXLBOJIQ-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