General Information of the Compound
| Compound ID |
CP0387763
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| Compound Name |
(+/-)-N-(((1S,2S)-2-(3-(2-chloro-4-fluorophenyl)-1,2,4-oxadiazol-5-yl)cyclopropyl)methyl)quinolin-3-amine
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| Structure |
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| Formula |
C21H16ClFN4O
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| Molecular Weight |
394.837
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| Canonical SMILES |
Fc1ccc(-c2noc(n2)[C@H]2C[C@@H]2CNc2cnc3ccccc3c2)c(Cl)c1
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| InChI |
InChI=1S/C21H16ClFN4O/c22-18-9-14(23)5-6-16(18)20-26-21(28-27-20)17-8-13(17)10-24-15-7-12-3-1-2-4-19(12)25-11-15/h1-7,9,11,13,17,24H,8,10H2/t13-,17+/m1/s1
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| InChIKey |
FBHJVGRJVGEERY-DYVFJYSZSA-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