General Information of the Compound
| Compound ID |
CP0543536
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| Compound Name |
2-N-(2-methylpropyl)-6-phenyl-4-N-(pyridin-3-ylmethyl)thieno[3,2-d]pyrimidine-2,4-diamine
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| Structure |
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| Formula |
C22H23N5S
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| Molecular Weight |
389.528
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| Canonical SMILES |
CC(C)CNc1nc(NCc2cccnc2)c2sc(cc2n1)-c1ccccc1
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| InChI |
InChI=1S/C22H23N5S/c1-15(2)12-25-22-26-18-11-19(17-8-4-3-5-9-17)28-20(18)21(27-22)24-14-16-7-6-10-23-13-16/h3-11,13,15H,12,14H2,1-2H3,(H2,24,25,26,27)
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| InChIKey |
URPRPVSDXFXRTH-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