General Information of the Compound
| Compound ID |
CP0578466
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| Compound Name |
N3-(3-Chloro-4- fluorophenyl)- 5-isopropoxy-7- phenylfuro[2,3- c]pyridine-2,3- diamine
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| Structure |
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| Formula |
C22H19ClFN3O2
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| Molecular Weight |
411.864
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| Canonical SMILES |
CC(C)Oc1cc2c(Nc3ccc(F)c(Cl)c3)c(N)oc2c(n1)-c1ccccc1
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| InChI |
InChI=1S/C22H19ClFN3O2/c1-12(2)28-18-11-15-20(26-14-8-9-17(24)16(23)10-14)22(25)29-21(15)19(27-18)13-6-4-3-5-7-13/h3-12,26H,25H2,1-2H3
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| InChIKey |
YHPXTDKOAILMTM-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