General Information of the Compound
| Compound ID |
CP0007930
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| Compound Name |
N-[5-[7-[[(2R)-4-(2-hydroxy-2-methylpropyl)morpholin-2-yl]methoxy]-1,3-dihydro-2-benzofuran-5-yl]-2-methoxypyridin-3-yl]-2-methoxyethanesulfonamide
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| Structure |
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| Formula |
C26H37N3O8S
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| Molecular Weight |
551.662
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| Canonical SMILES |
COCCS(=O)(=O)Nc1cc(cnc1OC)-c1cc2COCc2c(OC[C@H]2CN(CC(C)(C)O)CCO2)c1
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| InChI |
InChI=1S/C26H37N3O8S/c1-26(2,30)17-29-5-6-36-21(13-29)15-37-24-11-18(9-20-14-35-16-22(20)24)19-10-23(25(34-4)27-12-19)28-38(31,32)8-7-33-3/h9-12,21,28,30H,5-8,13-17H2,1-4H3/t21-/m1/s1
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| InChIKey |
ORYFQMZJJLEVHU-OAQYLSRUSA-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