General Information of the Compound
| Compound ID |
CP0917737
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| Compound Name |
Methyl trans-4-methyl-2-(4-(3-(piperidin-1-yl)cyclobutoxy)phenyl)oxazole-5-carboxylate
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| Formula |
C21H26N2O4
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| Molecular Weight |
370.449
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| Canonical SMILES |
COC(=O)c1oc(-c2ccc(O[C@H]3C[C@H](N4CCCCC4)C3)cc2)nc1C
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| InChI |
InChI=1S/C21H26N2O4/c1-14-19(21(24)25-2)27-20(22-14)15-6-8-17(9-7-15)26-18-12-16(13-18)23-10-4-3-5-11-23/h6-9,16,18H,3-5,10-13H2,1-2H3/t16-,18-
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| InChIKey |
HLHCBXACXOAEIP-SAABIXHNSA-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