General Information of the Compound
| Compound ID |
CP0116106
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| Compound Name |
5-(4-fluorophenyl)-3-(2H-pyrazolo[3,4-b]pyridin-3-ylmethyl)triazolo[4,5-b]pyrazine
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| Structure |
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| Formula |
C17H11FN8
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| Molecular Weight |
346.329
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| Canonical SMILES |
Fc1ccc(cc1)-c1cnc2nnn(Cc3n[nH]c4ncccc34)c2n1
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| InChI |
InChI=1S/C17H11FN8/c18-11-5-3-10(4-6-11)13-8-20-16-17(21-13)26(25-24-16)9-14-12-2-1-7-19-15(12)23-22-14/h1-8H,9H2,(H,19,22,23)
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| InChIKey |
ARNKXFZQMPFVOP-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