General Information of the Compound
| Compound ID |
CP0538786
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| Compound Name |
N-[6-[(6-chloro-1,2,3,4-tetrahydroacridin-9-yl)amino]hexyl]-2-(7-methoxy-2-methyl-6-phenylmethoxy-3,4-dihydrochromen-2-yl)acetamide
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| Formula |
C39H46ClN3O4
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| Molecular Weight |
656.267
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| Canonical SMILES |
COc1cc2OC(C)(CC(=O)NCCCCCCNc3c4CCCCc4nc4cc(Cl)ccc34)CCc2cc1OCc1ccccc1
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| InChI |
InChI=1S/C39H46ClN3O4/c1-39(19-18-28-22-36(35(45-2)24-34(28)47-39)46-26-27-12-6-5-7-13-27)25-37(44)41-20-10-3-4-11-21-42-38-30-14-8-9-15-32(30)43-33-23-29(40)16-17-31(33)38/h5-7,12-13,16-17,22-24H,3-4,8-11,14-15,18-21,25-26H2,1-2H3,(H,41,44)(H,42,43)
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| InChIKey |
SRUORENXKCKPFF-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