General Information of the Compound
| Compound ID |
CP0482294
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| Compound Name |
N3-(3-Ethynyl- 4- fluorophenyl)- 7- phenylfuro[2,3- c]pyridine-2,3- diamine
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| Structure |
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| Formula |
C21H14FN3O
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| Molecular Weight |
343.361
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| Canonical SMILES |
Nc1oc2c(nccc2c1Nc1ccc(F)c(c1)C#C)-c1ccccc1
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| InChI |
InChI=1S/C21H14FN3O/c1-2-13-12-15(8-9-17(13)22)25-19-16-10-11-24-18(20(16)26-21(19)23)14-6-4-3-5-7-14/h1,3-12,25H,23H2
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| InChIKey |
ZYSNIMKMPVZWPB-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