General Information of the Compound
| Compound ID |
CP0424579
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| Compound Name |
1-[3-[4-[[4-(1-methylpyrazol-4-yl)triazol-1-yl]methyl]phenyl]-1,2,4-oxadiazol-5-yl]cyclopropane-1-carboximidamide;hydrochloride
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| Formula |
C19H20ClN9O
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| Molecular Weight |
425.884
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| Canonical SMILES |
Cl.Cn1cc(cn1)-c1cn(Cc2ccc(cc2)-c2noc(n2)C2(CC2)C(N)=N)nn1
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| InChI |
InChI=1S/C19H19N9O.ClH/c1-27-10-14(8-22-27)15-11-28(26-24-15)9-12-2-4-13(5-3-12)16-23-18(29-25-16)19(6-7-19)17(20)21;/h2-5,8,10-11H,6-7,9H2,1H3,(H3,20,21);1H
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| InChIKey |
UUJLUHKZXDMOBW-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