General Information of the Compound
| Compound ID |
CP0956767
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| Compound Name |
4,4-dimethyl-2-(4-(3-(piperidin-1-yl)propoxy)phenyl)-4,5-dihydrooxazole
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| Structure |
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| Formula |
C19H28N2O2
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| Molecular Weight |
316.445
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| Canonical SMILES |
CC1(C)COC(c2ccc(OCCCN3CCCCC3)cc2)=N1
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| InChI |
InChI=1S/C19H28N2O2/c1-19(2)15-23-18(20-19)16-7-9-17(10-8-16)22-14-6-13-21-11-4-3-5-12-21/h7-10H,3-6,11-15H2,1-2H3
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| InChIKey |
VBUXZJLFLMHLLC-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