General Information of the Compound
| Compound ID |
CP0445904
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| Compound Name |
N3-(3-Chloro-4- fluorophenyl)- 7-(pyridin-3- yl)furo[2,3- c]pyridine-2,3- diamine
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| Structure |
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| Formula |
C18H12ClFN4O
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| Molecular Weight |
354.772
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| Canonical SMILES |
Nc1oc2c(nccc2c1Nc1ccc(F)c(Cl)c1)-c1cccnc1
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| InChI |
InChI=1S/C18H12ClFN4O/c19-13-8-11(3-4-14(13)20)24-16-12-5-7-23-15(17(12)25-18(16)21)10-2-1-6-22-9-10/h1-9,24H,21H2
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| InChIKey |
KTMSEJGAPQPXSK-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