General Information of the Compound
| Compound ID |
CP0415363
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| Compound Name |
N-[1-[2-[3-[3-(cyclopropylmethoxy)phenoxy]azetidin-1-yl]-1,3-benzoxazol-6-yl]ethyl]acetamide
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| Structure |
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| Formula |
C24H27N3O4
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| Molecular Weight |
421.497
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| Canonical SMILES |
CC(NC(C)=O)c1ccc2nc(oc2c1)N1CC(C1)Oc1cccc(OCC2CC2)c1
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| InChI |
InChI=1S/C24H27N3O4/c1-15(25-16(2)28)18-8-9-22-23(10-18)31-24(26-22)27-12-21(13-27)30-20-5-3-4-19(11-20)29-14-17-6-7-17/h3-5,8-11,15,17,21H,6-7,12-14H2,1-2H3,(H,25,28)
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| InChIKey |
OQORVSGUAORZBX-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: PT01270, Acetyl-CoA carboxylase 1
Protein ID: PT01119, Acetyl-CoA carboxylase 2