General Information of the Compound
Compound ID |
CP0731116
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Compound Name |
(S)-7-(6-fluoropyridin-2-yl)-3-(2-fluoropyridin-4-yl)-5'H-spiro[chromeno[2,3-c]pyridine-5,4'-oxazol]-2'-amine
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Structure |
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Formula |
C24H15F2N5O2
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Molecular Weight |
443.413
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Canonical SMILES |
NC1=N[C@@]2(CO1)c1cc(-c3cccc(F)n3)ccc1Oc1cnc(-c3ccnc(F)c3)cc12
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InChI |
InChI=1S/C24H15F2N5O2/c25-21-3-1-2-17(30-21)13-4-5-19-15(8-13)24(12-32-23(27)31-24)16-10-18(29-11-20(16)33-19)14-6-7-28-22(26)9-14/h1-11H,12H2,(H2,27,31)/t24-/m0/s1
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InChIKey |
DZCDXEUMHLFNQV-DEOSSOPVSA-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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