General Information of the Compound
| Compound ID |
CP0414967
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| Compound Name |
N3-(3-(tert- Butyl)phenyl) furo[2,3- c]pyridine-2,3- diamine
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| Structure |
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| Formula |
C17H19N3O
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| Molecular Weight |
281.359
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| Canonical SMILES |
CC(C)(C)c1cccc(Nc2c(N)oc3cnccc23)c1
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| InChI |
InChI=1S/C17H19N3O/c1-17(2,3)11-5-4-6-12(9-11)20-15-13-7-8-19-10-14(13)21-16(15)18/h4-10,20H,18H2,1-3H3
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| InChIKey |
QIKWAGDVGDBFGW-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