General Information of the Compound
| Compound ID |
CP0960131
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| Compound Name |
(S)-N'1-(6-Phenyl-2-pyridin-4-yl-thieno[3,2-d]pyrimidin-4-yl)-propane-1,2-diamine
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| Structure |
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| Formula |
C20H19N5S
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| Molecular Weight |
361.474
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| Canonical SMILES |
C[C@H](N)CNc1nc(-c2ccncc2)nc2cc(-c3ccccc3)sc12
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| InChI |
InChI=1S/C20H19N5S/c1-13(21)12-23-20-18-16(11-17(26-18)14-5-3-2-4-6-14)24-19(25-20)15-7-9-22-10-8-15/h2-11,13H,12,21H2,1H3,(H,23,24,25)/t13-/m0/s1
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| InChIKey |
VHFKPRNRSLTBPE-ZDUSSCGKSA-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