General Information of the Compound
| Compound ID |
CP0452183
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| Compound Name |
N-(1H-indazol-5-yl)-1H-pyrrole-2-carboxamide
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| Structure |
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| Formula |
C12H10N4O
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| Molecular Weight |
226.239
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| Canonical SMILES |
O=C(Nc1ccc2[nH]ncc2c1)c1ccc[nH]1
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| InChI |
InChI=1S/C12H10N4O/c17-12(11-2-1-5-13-11)15-9-3-4-10-8(6-9)7-14-16-10/h1-7,13H,(H,14,16)(H,15,17)
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| InChIKey |
YABCYWQDIKJEOG-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
Protein ID: PT00840, Adenosine receptor A1
Protein ID: PT05120, Transmembrane domain-containing protein TMIGD3