General Information of the Compound
| Compound ID |
CP0380248
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| Compound Name |
3-(1-cyclopentylbenzotriazol-5-yl)-5-(4-fluorophenyl)-1,2,4-oxadiazole
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| Structure |
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| Formula |
C19H16FN5O
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| Molecular Weight |
349.369
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| Canonical SMILES |
Fc1ccc(cc1)-c1nc(no1)-c1ccc2n(nnc2c1)C1CCCC1
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| InChI |
InChI=1S/C19H16FN5O/c20-14-8-5-12(6-9-14)19-21-18(23-26-19)13-7-10-17-16(11-13)22-24-25(17)15-3-1-2-4-15/h5-11,15H,1-4H2
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| InChIKey |
LRRVNQIIXFMMNH-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