General Information of the Compound
| Compound ID |
CP0731120
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| Compound Name |
(S)-N-(2'-amino-3-methoxy-5'H-spiro[chromeno[2,3-c]pyridine-5,4'-oxazole]-7-yl)-5-chloropicolinamide
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| Structure |
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| Formula |
C21H16ClN5O4
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| Molecular Weight |
437.843
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| Canonical SMILES |
COc1cc2c(cn1)Oc1ccc(NC(=O)c3ccc(Cl)cn3)cc1[C@@]21COC(N)=N1
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| InChI |
InChI=1S/C21H16ClN5O4/c1-29-18-7-14-17(9-25-18)31-16-5-3-12(6-13(16)21(14)10-30-20(23)27-21)26-19(28)15-4-2-11(22)8-24-15/h2-9H,10H2,1H3,(H2,23,27)(H,26,28)/t21-/m0/s1
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| InChIKey |
AVEZNGUMQADLGB-NRFANRHFSA-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