General Information of the Compound
| Compound ID |
CP0849186
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| Compound Name |
5-(2-amino-3-cyano-7-(furan-2-yl)-5-oxo-5,6,7,8-tetrahydro-4H-chromen-4-yl)-2-methoxyphenyl morpholine-4-carboxylate
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| Structure |
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| Formula |
C26H25N3O7
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| Molecular Weight |
491.5
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| Canonical SMILES |
COc1ccc(C2C(C#N)=C(N)OC3=C2C(=O)CC(c2ccco2)C3)cc1OC(=O)N1CCOCC1
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| InChI |
InChI=1S/C26H25N3O7/c1-32-20-5-4-15(12-21(20)36-26(31)29-6-9-33-10-7-29)23-17(14-27)25(28)35-22-13-16(11-18(30)24(22)23)19-3-2-8-34-19/h2-5,8,12,16,23H,6-7,9-11,13,28H2,1H3
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| InChIKey |
RIOQOZJDLKYMQC-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