General Information of the Compound
| Compound ID |
CP0132279
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| Compound Name |
[5-amino-1-(2-methyl-3H-benzimidazol-5-yl)pyrazol-4-yl]-(6-methyl-1H-indol-2-yl)methanone
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| Structure |
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| Formula |
C21H18N6O
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| Molecular Weight |
370.416
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| Canonical SMILES |
Cc1nc2ccc(cc2[nH]1)-n1ncc(C(=O)c2cc3ccc(C)cc3[nH]2)c1N
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| InChI |
InChI=1S/C21H18N6O/c1-11-3-4-13-8-19(26-17(13)7-11)20(28)15-10-23-27(21(15)22)14-5-6-16-18(9-14)25-12(2)24-16/h3-10,26H,22H2,1-2H3,(H,24,25)
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| InChIKey |
VXIMXYPRIKHTPC-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