General Information of the Compound
| Compound ID |
CP0900429
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| Compound Name |
Trans-2-(4-(3-(piperidin-1-yl)cyclobutoxy)phenyl)-4-(piperidin-1-ylmethyl)oxazole
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| Formula |
C24H33N3O2
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| Molecular Weight |
395.547
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| Canonical SMILES |
c1cc(-c2nc(CN3CCCCC3)co2)ccc1O[C@H]1C[C@H](N2CCCCC2)C1
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| InChI |
InChI=1S/C24H33N3O2/c1-3-11-26(12-4-1)17-20-18-28-24(25-20)19-7-9-22(10-8-19)29-23-15-21(16-23)27-13-5-2-6-14-27/h7-10,18,21,23H,1-6,11-17H2/t21-,23-
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| InChIKey |
YYTUUMMLIAARDY-AFARHQOCSA-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