General Information of the Compound
| Compound ID |
CP0850722
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| Compound Name |
2-Pyridin-4-yl-N'4-(R)-pyrrolidin-3-yl-thieno[3,2-d]pyrimidine-4,7-diamine
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| Structure |
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| Formula |
C15H16N6S
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| Molecular Weight |
312.402
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| Canonical SMILES |
Nc1csc2c(N[C@@H]3CCNC3)nc(-c3ccncc3)nc12
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| InChI |
InChI=1S/C15H16N6S/c16-11-8-22-13-12(11)20-14(9-1-4-17-5-2-9)21-15(13)19-10-3-6-18-7-10/h1-2,4-5,8,10,18H,3,6-7,16H2,(H,19,20,21)/t10-/m1/s1
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| InChIKey |
YNVRAHAXZSAZDX-SNVBAGLBSA-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