General Information of the Compound
| Compound ID |
CP0399732
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| Compound Name |
N-[2-(4-chlorophenyl)ethyl]-N-(1,4-dioxaspiro[4.5]decan-8-yl)-1,2-benzoxazole-3-carboxamide
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| Structure |
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| Formula |
C24H25ClN2O4
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| Molecular Weight |
440.927
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| Canonical SMILES |
Clc1ccc(CCN(C2CCC3(CC2)OCCO3)C(=O)c2noc3ccccc23)cc1
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| InChI |
InChI=1S/C24H25ClN2O4/c25-18-7-5-17(6-8-18)11-14-27(19-9-12-24(13-10-19)29-15-16-30-24)23(28)22-20-3-1-2-4-21(20)31-26-22/h1-8,19H,9-16H2
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| InChIKey |
TXJDQMSODATXQW-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