General Information of the Compound
| Compound ID |
CP0951873
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| Compound Name |
(S)-N'1-[2-(3-Fluoro-pyridin-4-yl)-thieno[3,2-d]pyrimidin-4-yl]-propane-1,2-diamine
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| Structure |
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| Formula |
C14H14FN5S
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| Molecular Weight |
303.366
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| Canonical SMILES |
C[C@H](N)CNc1nc(-c2ccncc2F)nc2ccsc12
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| InChI |
InChI=1S/C14H14FN5S/c1-8(16)6-18-14-12-11(3-5-21-12)19-13(20-14)9-2-4-17-7-10(9)15/h2-5,7-8H,6,16H2,1H3,(H,18,19,20)/t8-/m0/s1
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| InChIKey |
IPRXIWAKNRLQSG-QMMMGPOBSA-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