General Information of the Compound
| Compound ID |
CP0361103
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| Compound Name |
5-[[5-(1-methylpyrazol-4-yl)triazolo[4,5-b]pyrazin-3-yl]methyl]-1H-thieno[3,2-c]pyrazole
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| Structure |
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| Formula |
C14H11N9S
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| Molecular Weight |
337.372
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| Canonical SMILES |
Cn1cc(cn1)-c1cnc2nnn(Cc3cc4[nH]ncc4s3)c2n1
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| InChI |
InChI=1S/C14H11N9S/c1-22-6-8(3-17-22)11-4-15-13-14(18-11)23(21-20-13)7-9-2-10-12(24-9)5-16-19-10/h2-6H,7H2,1H3,(H,16,19)
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| InChIKey |
LHOBRKZKLMMCMG-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