General Information of the Compound
| Compound ID |
CP0507122
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| Compound Name |
3-benzyl-4-butyl-8-(1-(2,6-dimethylbenzoyl)piperidin-4-yl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one
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| Structure |
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| Formula |
C32H43N3O3
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| Molecular Weight |
517.714
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| Canonical SMILES |
CCCCC1N(Cc2ccccc2)C(=O)OC11CCN(CC1)C1CCN(CC1)C(=O)c1c(C)cccc1C
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| InChI |
InChI=1S/C32H43N3O3/c1-4-5-14-28-32(38-31(37)35(28)23-26-12-7-6-8-13-26)17-21-33(22-18-32)27-15-19-34(20-16-27)30(36)29-24(2)10-9-11-25(29)3/h6-13,27-28H,4-5,14-23H2,1-3H3
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| InChIKey |
OVAAQBKFWMSBDM-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