General Information of the Compound
| Compound ID |
CP0126600
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| Compound Name |
3-[3-(dimethylamino)phenyl]-N-(piperidin-4-ylmethyl)triazolo[4,5-b]pyridin-5-amine
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| Structure |
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| Formula |
C19H25N7
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| Molecular Weight |
351.458
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| Canonical SMILES |
CN(C)c1cccc(c1)-n1nnc2ccc(NCC3CCNCC3)nc12
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| InChI |
InChI=1S/C19H25N7/c1-25(2)15-4-3-5-16(12-15)26-19-17(23-24-26)6-7-18(22-19)21-13-14-8-10-20-11-9-14/h3-7,12,14,20H,8-11,13H2,1-2H3,(H,21,22)
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| InChIKey |
NFMGQYVXXDIVFX-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