General Information of the Compound
| Compound ID |
CP0104346
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| Compound Name |
N-(1H-indazol-5-yl)-2-(2-pyridin-4-ylethyl)pyrazole-3-carboxamide
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| Structure |
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| Formula |
C18H16N6O
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| Molecular Weight |
332.367
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| Canonical SMILES |
O=C(Nc1ccc2[nH]ncc2c1)c1ccnn1CCc1ccncc1
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| InChI |
InChI=1S/C18H16N6O/c25-18(22-15-1-2-16-14(11-15)12-20-23-16)17-5-9-21-24(17)10-6-13-3-7-19-8-4-13/h1-5,7-9,11-12H,6,10H2,(H,20,23)(H,22,25)
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| InChIKey |
PHQCLGWHZXXATF-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