General Information of the Compound
| Compound ID |
CP0577882
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| Compound Name |
3-amino-4-[(3S)-3-(methoxymethyl)piperidin-1-yl]thieno[2,3-b]pyridine-2-carboxamide
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| Structure |
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| Formula |
C15H20N4O2S
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| Molecular Weight |
320.418
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| Canonical SMILES |
COC[C@H]1CCCN(C1)c1ccnc2sc(C(N)=O)c(N)c12
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| InChI |
InChI=1S/C15H20N4O2S/c1-21-8-9-3-2-6-19(7-9)10-4-5-18-15-11(10)12(16)13(22-15)14(17)20/h4-5,9H,2-3,6-8,16H2,1H3,(H2,17,20)/t9-/m0/s1
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| InChIKey |
DNSJYEBNZGXVJX-VIFPVBQESA-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