General Information of the Compound
| Compound ID |
CP0957603
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| Compound Name |
1-((2-(3-chlorophenyl)-5-methyloxazol-4-yl)methyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide
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| Structure |
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| Formula |
C27H30ClN3O2
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| Molecular Weight |
464.009
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| Canonical SMILES |
Cc1oc(-c2cccc(Cl)c2)nc1CN1CCC(C(=O)NC2CCCc3ccccc32)CC1
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| InChI |
InChI=1S/C27H30ClN3O2/c1-18-25(30-27(33-18)21-8-4-9-22(28)16-21)17-31-14-12-20(13-15-31)26(32)29-24-11-5-7-19-6-2-3-10-23(19)24/h2-4,6,8-10,16,20,24H,5,7,11-15,17H2,1H3,(H,29,32)
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| InChIKey |
BGYZVKLCNIDUKT-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