General Information of the Compound
| Compound ID |
CP0482298
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| Compound Name |
2-[3-[(4-tert-butylbenzoyl)amino]phenyl]-N-methyl-4-(4-morpholin-4-ylanilino)-1,3-thiazole-5-carboxamide
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| Structure |
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| Formula |
C32H35N5O3S
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| Molecular Weight |
569.731
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| Canonical SMILES |
CNC(=O)c1sc(nc1Nc1ccc(cc1)N1CCOCC1)-c1cccc(NC(=O)c2ccc(cc2)C(C)(C)C)c1
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| InChI |
InChI=1S/C32H35N5O3S/c1-32(2,3)23-10-8-21(9-11-23)29(38)35-25-7-5-6-22(20-25)31-36-28(27(41-31)30(39)33-4)34-24-12-14-26(15-13-24)37-16-18-40-19-17-37/h5-15,20,34H,16-19H2,1-4H3,(H,33,39)(H,35,38)
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| InChIKey |
UMBMMFZBZPDOCY-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