General Information of the Compound
| Compound ID |
CP0450262
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| Compound Name |
2-(16-Chloro-17,19-dihydroxy-4-methyl-2-oxo-3,7-dioxa-tricyclo[13.4.0.0*6,8*]nonadeca-1(19),9,11,15,17-pentaen-13-ylideneaminooxy)-N-(2-diethylamino-ethyl)-acetamide
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| Structure |
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| Formula |
C26H34ClN3O7
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| Molecular Weight |
536.025
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| Canonical SMILES |
CCN(CC)CCNC(=O)CO\N=C1\Cc2c(Cl)c(O)cc(O)c2C(=O)O[C@H](C)C[C@H]2O[C@@H]2/C=C\C=C\1
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| InChI |
InChI=1S/C26H34ClN3O7/c1-4-30(5-2)11-10-28-23(33)15-35-29-17-8-6-7-9-21-22(37-21)12-16(3)36-26(34)24-18(13-17)25(27)20(32)14-19(24)31/h6-9,14,16,21-22,31-32H,4-5,10-13,15H2,1-3H3,(H,28,33)/b8-6+,9-7-,29-17+/t16-,21-,22-/m1/s1
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| InChIKey |
DCKIPTMXBWULFX-PVMWYJNOSA-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