General Information of the Compound
| Compound ID |
CP0489552
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| Compound Name |
N3-(3-Chloro-4- fluorophenyl)- 7-propylfuro [2,3-c]pyridine- 2,3-diamine
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| Structure |
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| Formula |
C16H15ClFN3O
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| Molecular Weight |
319.767
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| Canonical SMILES |
CCCc1nccc2c(Nc3ccc(F)c(Cl)c3)c(N)oc12
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| InChI |
InChI=1S/C16H15ClFN3O/c1-2-3-13-15-10(6-7-20-13)14(16(19)22-15)21-9-4-5-12(18)11(17)8-9/h4-8,21H,2-3,19H2,1H3
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| InChIKey |
QZTGRKHJXHPCKW-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