General Information of the Compound
| Compound ID |
CP0475366
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| Compound Name |
tert-butyl 4-[[6-[4-(oxazinane-2-carbonyl)phenyl]pyridin-3-yl]oxymethyl]piperidine-1-carboxylate
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| Structure |
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| Formula |
C27H35N3O5
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| Molecular Weight |
481.593
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| Canonical SMILES |
CC(C)(C)OC(=O)N1CCC(COc2ccc(nc2)-c2ccc(cc2)C(=O)N2CCCCO2)CC1
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| InChI |
InChI=1S/C27H35N3O5/c1-27(2,3)35-26(32)29-15-12-20(13-16-29)19-33-23-10-11-24(28-18-23)21-6-8-22(9-7-21)25(31)30-14-4-5-17-34-30/h6-11,18,20H,4-5,12-17,19H2,1-3H3
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| InChIKey |
YHCBNYKBGJBKNA-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