General Information of the Compound
| Compound ID |
CP0918244
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| Compound Name |
(7-Bromo-2-pyridin-4-yl-thieno[3,2-d]pyrimidin-4-yl)-(R)-piperidin-3-yl-amine
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| Structure |
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| Formula |
C16H16BrN5S
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| Molecular Weight |
390.31
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| Canonical SMILES |
Brc1csc2c(N[C@@H]3CCCNC3)nc(-c3ccncc3)nc12
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| InChI |
InChI=1S/C16H16BrN5S/c17-12-9-23-14-13(12)21-15(10-3-6-18-7-4-10)22-16(14)20-11-2-1-5-19-8-11/h3-4,6-7,9,11,19H,1-2,5,8H2,(H,20,21,22)/t11-/m1/s1
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| InChIKey |
NPJOOMJSBHGIHL-LLVKDONJSA-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