General Information of the Compound
| Compound ID |
CP0951860
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| Compound Name |
(S)-N'1-(7-Methyl-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 |
C15H17N5S
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| Molecular Weight |
299.403
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| Canonical SMILES |
Cc1csc2c(NC[C@H](C)N)nc(-c3ccncc3)nc12
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| InChI |
InChI=1S/C15H17N5S/c1-9-8-21-13-12(9)19-14(11-3-5-17-6-4-11)20-15(13)18-7-10(2)16/h3-6,8,10H,7,16H2,1-2H3,(H,18,19,20)/t10-/m0/s1
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| InChIKey |
SHNWYNBRVPIDQS-JTQLQIEISA-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