General Information of the Compound
| Compound ID |
CP0952332
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| Compound Name |
6-(9-(6-chloro-1,2,3,4-tetrahydroacridin-9-ylamino)nonylamino)-5,6,7,8-tetrahydroquinolin-2(1H)-one
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| Structure |
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| Formula |
C31H41ClN4O
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| Molecular Weight |
521.149
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| Canonical SMILES |
O=c1ccc2c([nH]1)CCC(NCCCCCCCCCNc1c3c(nc4cc(Cl)ccc14)CCCC3)C2
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| InChI |
InChI=1S/C31H41ClN4O/c32-23-13-15-26-29(21-23)35-28-11-7-6-10-25(28)31(26)34-19-9-5-3-1-2-4-8-18-33-24-14-16-27-22(20-24)12-17-30(37)36-27/h12-13,15,17,21,24,33H,1-11,14,16,18-20H2,(H,34,35)(H,36,37)
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| InChIKey |
VYHFAHCHRHNJPA-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