General Information of the Compound
| Compound ID |
CP0871793
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| Compound Name |
5-(2-((2-(1H-benzo[d]imidazol-2-yl)ethyl)amino)ethyl)-N-(pyridin-2-ylmethyl)-1,2,4-oxadiazole-3-carboxamide
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| Structure |
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| Formula |
C20H21N7O2
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| Molecular Weight |
391.435
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| Canonical SMILES |
O=C(NCc1ccccn1)c1noc(CCNCCc2nc3ccccc3[nH]2)n1
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| InChI |
InChI=1S/C20H21N7O2/c28-20(23-13-14-5-3-4-10-22-14)19-26-18(29-27-19)9-12-21-11-8-17-24-15-6-1-2-7-16(15)25-17/h1-7,10,21H,8-9,11-13H2,(H,23,28)(H,24,25)
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| InChIKey |
IGXZPLCHVJWNKZ-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