General Information of the Compound
| Compound ID |
CP0334869
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| Compound Name |
3-[(4-methoxyphenyl)methyl]-5-(1-methylpyrazol-4-yl)triazolo[4,5-b]pyrazine
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| Structure |
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| Formula |
C16H15N7O
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| Molecular Weight |
321.344
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| Canonical SMILES |
COc1ccc(Cn2nnc3ncc(nc23)-c2cnn(C)c2)cc1
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| InChI |
InChI=1S/C16H15N7O/c1-22-10-12(7-18-22)14-8-17-15-16(19-14)23(21-20-15)9-11-3-5-13(24-2)6-4-11/h3-8,10H,9H2,1-2H3
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| InChIKey |
ONQWNZBTZPQULG-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