General Information of the Compound
| Compound ID |
CP0361728
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| Compound Name |
N-methyl-4-propan-2-yloxy-2-[2-[[2-[2-(1,2,3,4-tetrahydroacridin-9-ylamino)ethylamino]acetyl]amino]pyridin-4-yl]-1,3-thiazole-5-carboxamide
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| Formula |
C30H35N7O3S
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| Molecular Weight |
573.723
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| Canonical SMILES |
CNC(=O)c1sc(nc1OC(C)C)-c1ccnc(NC(=O)CNCCNc2c3CCCCc3nc3ccccc23)c1
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| InChI |
InChI=1S/C30H35N7O3S/c1-18(2)40-29-27(28(39)31-3)41-30(37-29)19-12-13-33-24(16-19)36-25(38)17-32-14-15-34-26-20-8-4-6-10-22(20)35-23-11-7-5-9-21(23)26/h4,6,8,10,12-13,16,18,32H,5,7,9,11,14-15,17H2,1-3H3,(H,31,39)(H,34,35)(H,33,36,38)
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| InChIKey |
IOTWCKHUEXDRAB-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