General Information of the Compound
| Compound ID |
CP0503935
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| Compound Name |
5-(2-((1H-imidazol-5-yl)methylamino)pyridin-3-yl)-N-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-1,3,4-oxadiazol-2-amine
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| Structure |
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| Formula |
C19H17N7O3
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| Molecular Weight |
391.391
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| Canonical SMILES |
C(Nc1ncccc1-c1nnc(Nc2ccc3OCCOc3c2)o1)c1cnc[nH]1
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| InChI |
InChI=1S/C19H17N7O3/c1-2-14(17(21-5-1)22-10-13-9-20-11-23-13)18-25-26-19(29-18)24-12-3-4-15-16(8-12)28-7-6-27-15/h1-5,8-9,11H,6-7,10H2,(H,20,23)(H,21,22)(H,24,26)
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| InChIKey |
GGPXVYPZTUORQU-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