General Information of the Compound
| Compound ID |
CP0186188
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| Compound Name |
3-(2-Methyl-piperidin-1-yl)-N-{6-[3-(2-methyl-piperidin-1-yl)-propionylamino]-9-oxo-9,10-dihydro-acridin-3-yl}-propionamide
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| Structure |
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| Formula |
C31H41N5O3
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| Molecular Weight |
531.701
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| Canonical SMILES |
CC1CCCCN1CCC(=O)Nc1ccc2c(O)c3ccc(NC(=O)CCN4CCCCC4C)cc3nc2c1
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| InChI |
InChI=1S/C31H41N5O3/c1-21-7-3-5-15-35(21)17-13-29(37)32-23-9-11-25-27(19-23)34-28-20-24(10-12-26(28)31(25)39)33-30(38)14-18-36-16-6-4-8-22(36)2/h9-12,19-22H,3-8,13-18H2,1-2H3,(H,32,37)(H,33,38)(H,34,39)
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| InChIKey |
KKSPEFAKHLFRKN-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