General Information of the Compound
| Compound ID |
CP0270975
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| Compound Name |
(5-methyl-2-phenyl-1,3-oxazol-4-yl)-[4-[4-(pyrrolidin-1-ylmethyl)phenoxy]piperidin-1-yl]methanone
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| Structure |
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| Formula |
C27H31N3O3
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| Molecular Weight |
445.563
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| Canonical SMILES |
Cc1oc(nc1C(=O)N1CCC(CC1)Oc1ccc(CN2CCCC2)cc1)-c1ccccc1
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| InChI |
InChI=1S/C27H31N3O3/c1-20-25(28-26(32-20)22-7-3-2-4-8-22)27(31)30-17-13-24(14-18-30)33-23-11-9-21(10-12-23)19-29-15-5-6-16-29/h2-4,7-12,24H,5-6,13-19H2,1H3
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| InChIKey |
JHTKVHQOOVIELG-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