General Information of the Compound
| Compound ID |
CP0523719
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| Compound Name |
5-amino-2-(cyclopropylamino)-4-[3-[(4-methylphenyl)carbamoylamino]phenyl]thieno[2,3-d]pyrimidine-6-carboxamide
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| Structure |
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| Formula |
C24H23N7O2S
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| Molecular Weight |
473.562
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| Canonical SMILES |
Cc1ccc(NC(=O)Nc2cccc(c2)-c2nc(NC3CC3)nc3sc(C(N)=O)c(N)c23)cc1
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| InChI |
InChI=1S/C24H23N7O2S/c1-12-5-7-15(8-6-12)28-24(33)29-16-4-2-3-13(11-16)19-17-18(25)20(21(26)32)34-22(17)31-23(30-19)27-14-9-10-14/h2-8,11,14H,9-10,25H2,1H3,(H2,26,32)(H,27,30,31)(H2,28,29,33)
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| InChIKey |
QQZZOEDJZWYVGQ-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