General Information of the Compound
| Compound ID |
CP0553584
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| Compound Name |
N-[1-(2-pyrrolidin-1-ylethyl)benzimidazol-2-yl]-1H-pyrazole-5-carboxamide
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| Structure |
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| Formula |
C17H20N6O
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| Molecular Weight |
324.388
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| Canonical SMILES |
O=C(Nc1nc2ccccc2n1CCN1CCCC1)c1ccn[nH]1
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| InChI |
InChI=1S/C17H20N6O/c24-16(14-7-8-18-21-14)20-17-19-13-5-1-2-6-15(13)23(17)12-11-22-9-3-4-10-22/h1-2,5-8H,3-4,9-12H2,(H,18,21)(H,19,20,24)
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| InChIKey |
VYRGAYCCDVCPFG-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