General Information of the Compound
| Compound ID |
CP0513782
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| Compound Name |
2-(6-hydroxy-7-methoxy-2-methyl-3,4-dihydrochromen-2-yl)-N-[9-(1,2,3,4-tetrahydroacridin-9-ylamino)nonyl]acetamide
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| Formula |
C35H47N3O4
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| Molecular Weight |
573.778
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| Canonical SMILES |
COc1cc2OC(C)(CC(=O)NCCCCCCCCCNc3c4CCCCc4nc4ccccc34)CCc2cc1O
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| InChI |
InChI=1S/C35H47N3O4/c1-35(19-18-25-22-30(39)32(41-2)23-31(25)42-35)24-33(40)36-20-12-6-4-3-5-7-13-21-37-34-26-14-8-10-16-28(26)38-29-17-11-9-15-27(29)34/h8,10,14,16,22-23,39H,3-7,9,11-13,15,17-21,24H2,1-2H3,(H,36,40)(H,37,38)
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| InChIKey |
DFXFXZRLHHKPPR-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