General Information of the Compound
| Compound ID |
CP0315615
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| Compound Name |
2-[2-[7-[(6-chloro-1,2,3,4-tetrahydroacridin-9-yl)amino]heptylamino]ethyl]-7-methoxy-2-methyl-3,4-dihydrochromen-6-ol
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| Formula |
C33H44ClN3O3
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| Molecular Weight |
566.186
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| Canonical SMILES |
COc1cc2OC(C)(CCNCCCCCCCNc3c4CCCCc4nc4cc(Cl)ccc34)CCc2cc1O
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| InChI |
InChI=1S/C33H44ClN3O3/c1-33(15-14-23-20-29(38)31(39-2)22-30(23)40-33)16-19-35-17-8-4-3-5-9-18-36-32-25-10-6-7-11-27(25)37-28-21-24(34)12-13-26(28)32/h12-13,20-22,35,38H,3-11,14-19H2,1-2H3,(H,36,37)
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| InChIKey |
HWAJTAQZIKDHGT-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