General Information of the Compound
| Compound ID |
CP0221902
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| Compound Name |
6-(1-methylpyrazol-4-yl)-3-(1H-pyrrolo[2,3-b]pyridin-3-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazine
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| Structure |
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| Formula |
C17H14N8
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| Molecular Weight |
330.355
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| Canonical SMILES |
Cn1cc(cn1)-c1ccc2nnc(Cc3c[nH]c4ncccc34)n2n1
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| InChI |
InChI=1S/C17H14N8/c1-24-10-12(9-20-24)14-4-5-15-21-22-16(25(15)23-14)7-11-8-19-17-13(11)3-2-6-18-17/h2-6,8-10H,7H2,1H3,(H,18,19)
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| InChIKey |
SWKDQTACIUMMCD-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