General Information of the Compound
| Compound ID |
CP0904438
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| Compound Name |
[7-Methyl-6-(2-methyl-2H-pyrazol-3-yl)-2-pyridin-4-yl-thieno[3,2-d]pyrimidin-4-yl]-(R)-pyrrolidin-3-yl-amine
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| Structure |
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| Formula |
C20H21N7S
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| Molecular Weight |
391.504
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| Canonical SMILES |
Cc1c(-c2ccnn2C)sc2c(N[C@@H]3CCNC3)nc(-c3ccncc3)nc12
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| InChI |
InChI=1S/C20H21N7S/c1-12-16-18(28-17(12)15-6-10-23-27(15)2)20(24-14-5-9-22-11-14)26-19(25-16)13-3-7-21-8-4-13/h3-4,6-8,10,14,22H,5,9,11H2,1-2H3,(H,24,25,26)/t14-/m1/s1
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| InChIKey |
SVJMDUCZJDSJNH-CQSZACIVSA-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