General Information of the Compound
| Compound ID |
CP0424204
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| Compound Name |
N-(1H-indazol-5-yl)-1-methyl-6-phenylpyrrolo[3,2-b]pyridine-3-carboxamide
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| Structure |
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| Formula |
C22H17N5O
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| Molecular Weight |
367.412
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| Canonical SMILES |
Cn1cc(C(=O)Nc2ccc3[nH]ncc3c2)c2ncc(cc12)-c1ccccc1
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| InChI |
InChI=1S/C22H17N5O/c1-27-13-18(22(28)25-17-7-8-19-16(9-17)12-24-26-19)21-20(27)10-15(11-23-21)14-5-3-2-4-6-14/h2-13H,1H3,(H,24,26)(H,25,28)
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| InChIKey |
OCRAROWOEILBMO-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: PT01270, Acetyl-CoA carboxylase 1
Protein ID: PT01119, Acetyl-CoA carboxylase 2