General Information of the Compound
| Compound ID |
CP0562682
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| Compound Name |
butyl N-[[2-(2-methylpropyl)-4-[4-[(2-propan-2-ylimidazol-1-yl)methyl]phenyl]-1,3-thiazol-5-yl]sulfonyl]carbamate
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| Structure |
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| Formula |
C25H34N4O4S2
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| Molecular Weight |
518.705
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| Canonical SMILES |
CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)nc1-c1ccc(Cn2ccnc2C(C)C)cc1
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| InChI |
InChI=1S/C25H34N4O4S2/c1-6-7-14-33-25(30)28-35(31,32)24-22(27-21(34-24)15-17(2)3)20-10-8-19(9-11-20)16-29-13-12-26-23(29)18(4)5/h8-13,17-18H,6-7,14-16H2,1-5H3,(H,28,30)
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| InChIKey |
FIOPLWZBEHBZCZ-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
Protein ID: PT01197, Type-1 angiotensin II receptor
Protein ID: PT01553, Type-2 angiotensin II receptor